@prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
@prefix owl: <http://www.w3.org/2002/07/owl#> .
@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix xml: <http://www.w3.org/XML/1998/namespace> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .

<https://www.theworldavatar.com/kg/ontoreaction/> a owl:Ontology;
  <http://purl.org/dc/elements/1.1/date> "23 August 2024";
  rdfs:comment "An ontology developed for describing reaction experiment.";
  owl:versionInfo "1.11";
  <https://www.theworldavatar.com/kg/ontoreaction/gitCommitHash> "c0599beca8df55873a1ab061dee64e52c510c6a0" .

<http://purl.org/dc/elements/1.1/date> a owl:AnnotationProperty .

<https://www.theworldavatar.com/kg/ontoreaction/gitCommitHash> a owl:AnnotationProperty .

<http://www.theworldavatar.com/ontology/ontocape/material/substance/reaction_mechanism.owl#hasCatalyst>
  a owl:ObjectProperty .

<https://www.theworldavatar.com/kg/ontoreaction/hasAcidity> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/Chemical>;
  rdfs:range <http://www.ontology-of-units-of-measure.org/resource/om-2/Acidity>;
  rdfs:comment "A relation between a chemical and its acidity.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasBase> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/Base>;
  rdfs:comment "The relation hasBase denotes the bases of a ChemicalReaction.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasCatalyst> a owl:ObjectProperty;
  rdfs:subPropertyOf <http://www.theworldavatar.com/ontology/ontocape/material/substance/reaction_mechanism.owl#hasCatalyst>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/Catalyst>;
  rdfs:comment "The relation hasCatalyst denotes the catalysts of a ChemicalReaction. A catalyst is a MolecularEntity or a ChemicalSpecies that is used to accelerate a ChemicalReaction.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasConversion> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/Conversion>;
  rdfs:comment "A relation between a reaction experiment and its conversion performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasEcoScore> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/EcoScore>;
  rdfs:comment "A relation between a reaction experiment and its eco score performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasEndTime> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <http://www.w3.org/2006/time#Instant>;
  rdfs:comment "A relation between a reaction experiment and its end time.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasEnvironmentalFactor> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/EnvironmentalFactor>;
  rdfs:comment "A relation between a reaction experiment and its environmental factor performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasExpectedAcidity> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/Chemical>;
  rdfs:range <http://www.ontology-of-units-of-measure.org/resource/om-2/Acidity>;
  rdfs:comment "A relation between a chemical and its expected acidity.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasInputChemical> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/InputChemical>;
  rdfs:comment "A relation between a reaction experiment and its input chemicals. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasOperatorNotes> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/OperatorNotes>;
  rdfs:comment "A relation between a reaction experiment and its notes written by the operator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasOutputChemical> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/OutputChemical>;
  rdfs:comment "A relation between a reaction experiment and its output chemicals. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:comment "A relation between a reaction experiment and the performance indicator calculated from the measured analytical data of its output chemical. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>;
  rdfs:comment "A relation between a reaction experiment and all its reaction conditions.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasResTime> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ResidenceTime>;
  rdfs:comment "A relation between a reaction experiment and its residence time condition. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRunMaterialCost> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/RunMaterialCost>;
  rdfs:comment "A relation between a reaction experiment and its run material cost performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRunMaterialCostPerKilogramProduct>
  a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/RunMaterialCostPerKilogramProduct>;
  rdfs:comment "A relation between a reaction experiment and its run material cost per kilogram of product produced performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRxnPressure> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ReactionPressure>;
  rdfs:comment "A relation between a reaction experiment and its reaction pressure condition. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRxnScale> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ReactionScale>;
  rdfs:comment "A relation between a reaction experiment and its reaction scale specified to an input chemical. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRxnTemperature> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ReactionTemperature>;
  rdfs:comment "A relation between a reaction experiment and its reaction temperature condition. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRxnType> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range <http://purl.obolibrary.org/obo/MOP_0000543>;
  rdfs:comment "A relation between a ChemicalReaction and a named reaction class it belongs to. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasSolvent> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/Solvent>;
  rdfs:comment "The relation hasSolvent denotes the solvents of a ChemicalReaction. A solvent is a MolecularEntity or a ChemicalSpecies that is used to host a ChemicalReaction.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasSpaceTimeYield> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/SpaceTimeYield>;
  rdfs:comment "A relation between a reaction experiment and its space time yield performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasStartTime> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <http://www.w3.org/2006/time#Instant>;
  rdfs:comment "A relation between a reaction experiment and its start time.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasStoichiometryRatio> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasReactionCondition>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/StoichiometryRatio>;
  rdfs:comment "A relation between a reaction experiment and the stoichiometry ratio it applies to each input chemical. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasYield> a owl:ObjectProperty;
  rdfs:subPropertyOf <https://www.theworldavatar.com/kg/ontoreaction/hasPerformanceIndicator>;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/Yield>;
  rdfs:comment "A relation between a reaction experiment and its yield performance indicator.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/indicatesMultiplicityOf> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/StoichiometryRatio>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/InputChemical>;
  rdfs:comment "A relation indicates the multiplicity of the input chemical participating in a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/indicatesUsageOf> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionScale>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/InputChemical>;
  rdfs:comment "A relation indicates the reaction scale in form of usage of an input chemical. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/isAssignedTo> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontovapourtec/VapourtecR4Reactor>;
  rdfs:comment "A relation indicates the vapourtec R4 reactor where a reaction experiment happened. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/isOccurenceOf> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:comment "A relation between a reaction experiment and the chemical reaction it represents. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/isOperatedBy> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:range _:8046fe;
  rdfs:comment "A relation between a reaction experiment and its operator (An employee or student of an organization).";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:8046fe a owl:Class;
  owl:unionOf _:80470e .

_:80470e rdf:first <https://spec.edmcouncil.org/fibo/ontology/FND/Organizations/FormalOrganizations/Employee>;
  rdf:rest _:80471e .

_:80471e rdf:first <https://www.theworldavatar.com/kg/ontoprofile/Student>;
  rdf:rest rdf:nil .

<https://www.theworldavatar.com/kg/ontoreaction/isVariationOf> a owl:ObjectProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ReactionVariation>;
  rdfs:range <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>;
  rdfs:comment "A relation links a variation to its parent reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/yieldLimitingSpecies> a owl:ObjectProperty;
  rdfs:domain _:80472e;
  rdfs:range <http://www.theworldavatar.com/ontology/ontospecies/OntoSpecies.owl#Species>;
  rdfs:comment "A relation between yield or conversion of a reaction experiment and the yield limiting species based on which the performance indicator was computed. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:80472e a owl:Class;
  owl:unionOf _:80473e .

_:80473e rdf:first <https://www.theworldavatar.com/kg/ontoreaction/Conversion>;
  rdf:rest _:80474e .

_:80474e rdf:first <https://www.theworldavatar.com/kg/ontoreaction/Yield>;
  rdf:rest rdf:nil .

<https://www.theworldavatar.com/kg/ontoreaction/cdXML> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasInventoryNumber> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/Chemical>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRDFILE> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/hasRInChI> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ordID> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/rxnCXSMILES> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/rxnSMILES> a owl:DatatypeProperty;
  rdfs:domain <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction>;
  rdfs:range xsd:string;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<http://purl.obolibrary.org/obo/MOP_0000543> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/Acidity> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/AmountOfSubstanceFraction>
  a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/CelsiusTemperature> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/Duration> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/MassFraction> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/Pressure> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/Quantity> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/QuantityOfDimensionOne>
  a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/SpecificAmountOfMoney>
  a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/Volume> a owl:Class .

<http://www.ontology-of-units-of-measure.org/resource/om-2/VolumeFraction> a owl:Class .

<http://www.theworldavatar.com/ontology/ontocape/material/material.owl#Material> a
    owl:Class .

<http://www.theworldavatar.com/ontology/ontocape/material/substance/reaction_mechanism.owl#ChemicalReaction>
  a owl:Class .

<http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Product> a owl:Class .

<http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Species> a owl:Class .

<http://www.theworldavatar.com/ontology/ontospecies/OntoSpecies.owl#Species> a owl:Class .

<http://www.w3.org/2006/time#Instant> a owl:Class .

<https://spec.edmcouncil.org/fibo/ontology/FND/Organizations/FormalOrganizations/Employee>
  a owl:Class .

<https://www.theworldavatar.com/kg/ontoprofile/Student> a owl:Class .

<https://www.theworldavatar.com/kg/ontoreaction/Base> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Species>;
  rdfs:comment "A chemical species or molecular entity having an available pair of electrons capable of forming a covalent bond with a hydron (proton) (see Bronsted base) or with the vacant orbital of some other species (see Lewis base). [doi:10.1351/goldbook.B00601]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Catalyst> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Species>;
  rdfs:comment "A substance that increases the rate of a reaction without modifying the overall standard Gibbs energy change in the reaction. [doi:10.1351/goldbook.C00876]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Chemical> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontocape/material/material.owl#Material>;
  rdfs:comment "A chemical is a type of OntoCAPE:Material used as the conceptual representation of chemicals used involved in a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontocape/material/substance/reaction_mechanism.owl#ChemicalReaction>;
  rdfs:comment "A ChemicalReaction converts some ChemicalSpecies (or MolecularEntities) into some other ChemicalSpecies (or MolecularEntities). [OntoCAPE]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Conversion> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/AmountOfSubstanceFraction>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>, _:80475e;
  rdfs:comment "The conversion indicates, which portion of the originally used starting material has been converted into other chemical substances by a chemical reaction. [UDM https://github.com/PistoiaAlliance/UDM/blob/master/Docs/Glossary.md]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:80475e a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/yieldLimitingSpecies>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <http://www.theworldavatar.com/ontology/ontospecies/OntoSpecies.owl#Species> .

<https://www.theworldavatar.com/kg/ontoreaction/EcoScore> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/QuantityOfDimensionOne>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/EnvironmentalFactor> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/MassFraction>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:comment "The environmental factor (E-factor) of a reaction experiment is the ratio of the mass of waste (impurity) to mass of (desired/target) product. [doi:10.1039/B713736M]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Impurity> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Product>;
  rdfs:comment "The product that is not the desired outcome of a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/InputChemical> a owl:Class;
  rdfs:subClassOf <https://www.theworldavatar.com/kg/ontoreaction/Chemical>;
  rdfs:comment "An input chemical is a type of chemical used as the feed to a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/OperatorNotes> a owl:Class;
  rdfs:comment "Notes written by an operator regarding a reaction experiment.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/OutputChemical> a owl:Class;
  rdfs:subClassOf <https://www.theworldavatar.com/kg/ontoreaction/Chemical>;
  rdfs:comment "An output chemical is a type of chemical collected as outcome from a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator> a owl:Class;
  rdfs:comment "A quantity that is calculated from the measured analytical data of output chemical of a reaction experiment. It is used as objectives of a reaction optimisation problem. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition> a owl:Class;
  rdfs:comment "A quantity that is used to specify the condition at which the reaction is to be conducted. It can be used as the optimisation variable in a reaction development process.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment> a owl:Class;
  rdfs:subClassOf _:80476e, _:80477e, _:80478e, _:80479e, _:8047ae;
  rdfs:comment "A reaction experiment is a concrete realisation of a chemical reaction at a set of reaction conditions. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:80476e a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/hasResTime>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ResidenceTime> .

_:80477e a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/hasRxnPressure>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ReactionPressure> .

_:80478e a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/hasRxnScale>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ReactionScale> .

_:80479e a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/hasRxnTemperature>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ReactionTemperature> .

_:8047ae a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/isOccurenceOf>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ChemicalReaction> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionPressure> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/Pressure>,
    <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>;
  rdfs:comment "The pressure at which a reaction experiment is conducted. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionScale> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/Volume>,
    <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>, _:8047be;
  rdfs:comment "Reaction scale indicates the volume used of the reference input chemical. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:8047be a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/indicatesUsageOf>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/InputChemical> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionTemperature> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/CelsiusTemperature>,
    <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>;
  rdfs:comment "The temperature at which a reaction experiment is conducted. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/ReactionVariation> a owl:Class;
  rdfs:subClassOf <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment>,
    _:8047ce;
  rdfs:comment "A reaction variation is defined as the same chemical reaction performed at a different set of reaction conditions compared to its original conditions. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:8047ce a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/isVariationOf>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/ReactionExperiment> .

<https://www.theworldavatar.com/kg/ontoreaction/ResidenceTime> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/Duration>,
    <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>;
  rdfs:comment "The time required for air or reagent parcel to pass from the entrance to the exit of an instrument. Often this is approximated as the ratio of the interior volume of the device to the flow rate. [doi:10.1351/goldbook.R05309]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/RunMaterialCost> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/SpecificAmountOfMoney>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:comment "The total cost of input chemical during one reaction experiment, normally scaled by the volumetric amount of input chemicals. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/RunMaterialCostPerKilogramProduct>
  a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/SpecificAmountOfMoney>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:comment "The total cost of input chemical during one reaction experiment, scaled by per kilogram of product produced.";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Solvent> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Species>;
  rdfs:comment "A solvent is the substance used to solve the chemical components of the chemical reaction process. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/SpaceTimeYield> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/Quantity>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>;
  rdfs:comment "Space-time yield is a measure of reactor productivity calculated from mass of (desired/target) product formed, devided by the the reactor volume, and residence time. [doi:10.1002/cmtd.202000044]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/StoichiometryRatio> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/VolumeFraction>,
    <https://www.theworldavatar.com/kg/ontoreaction/ReactionCondition>, _:8047de;
  rdfs:comment "The ratio between an input chemical and the reference input chemical which is quantified by a reaction scale. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:8047de a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/indicatesMultiplicityOf>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <https://www.theworldavatar.com/kg/ontoreaction/InputChemical> .

<https://www.theworldavatar.com/kg/ontoreaction/TargetProduct> a owl:Class;
  rdfs:subClassOf <http://www.theworldavatar.com/ontology/ontokin/OntoKin.owl#Product>;
  rdfs:comment "The product that is the desired outcome of a reaction experiment. ";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

<https://www.theworldavatar.com/kg/ontoreaction/Yield> a owl:Class;
  rdfs:subClassOf <http://www.ontology-of-units-of-measure.org/resource/om-2/AmountOfSubstanceFraction>,
    <https://www.theworldavatar.com/kg/ontoreaction/PerformanceIndicator>, _:8047ee;
  rdfs:comment "Ratio expressing the efficiency of a mass conversion process. [doi:10.1351/goldbook.Y06724]";
  rdfs:isDefinedBy <https://www.theworldavatar.com/kg/ontoreaction/> .

_:8047ee a owl:Restriction;
  owl:onProperty <https://www.theworldavatar.com/kg/ontoreaction/yieldLimitingSpecies>;
  owl:qualifiedCardinality "1"^^xsd:nonNegativeInteger;
  owl:onClass <http://www.theworldavatar.com/ontology/ontospecies/OntoSpecies.owl#Species> .

<https://www.theworldavatar.com/kg/ontovapourtec/VapourtecR4Reactor> a owl:Class .