<?xml version="1.0" encoding="UTF-8"?> <rdf:RDF xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#" xmlns:obo_purl="http://purl.obolibrary.org/obo/" xmlns:owl="http://www.w3.org/2002/07/owl#" xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#" xmlns:skos="http://www.w3.org/2004/02/skos/core#" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata_def="http://data.bioontology.org/metadata/def/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_142468"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_134179"/> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_23128"/> <rdfs:label>1,2-dichloropropane</rdfs:label> <skos:notation>CHEBI:142468</skos:notation> <obo_purl:IAO_0000115>A chloroalkane that is propane in which a hydrogen from each of two adjacent carbons has been replaced by chlorines.</obo_purl:IAO_0000115> <oboinowl_gen:hasDbXref>Reaxys:1718880</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:142468</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <metadata_def:prefLabel>1,2-dichloropropane</metadata_def:prefLabel> <metadata_def:mappingLoom>12dichloropropane</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_142468"/> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C3H6Cl2</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>KNKRKFALVUDBJE-UHFFFAOYSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>112.986</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>111.98466</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>CC(CCl)Cl</obo_purl:chebi/smiles> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_142469"> <rdfs:subClassOf> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_142468"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_142468"/> </rdf:Description> </rdfs:subClassOf> </rdf:Description> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_142471"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_142468"/> </rdf:Description> </rdf:RDF>
<?xml version="1.0" encoding="UTF-8"?>
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    <skos:notation>CHEBI:142468</skos:notation>
    <obo_purl:IAO_0000115>A chloroalkane that is propane in which a hydrogen from each of two adjacent carbons has been replaced by chlorines.</obo_purl:IAO_0000115>
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    <metadata_def:mappingLoom>12dichloropropane</metadata_def:mappingLoom>
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    <obo_purl:chebi/charge>0</obo_purl:chebi/charge>
    <obo_purl:chebi/formula>C3H6Cl2</obo_purl:chebi/formula>
    <obo_purl:chebi/inchi>InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3</obo_purl:chebi/inchi>
    <obo_purl:chebi/inchikey>KNKRKFALVUDBJE-UHFFFAOYSA-N</obo_purl:chebi/inchikey>
    <obo_purl:chebi/mass>112.986</obo_purl:chebi/mass>
    <obo_purl:chebi/monoisotopicmass>111.98466</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/smiles>CC(CCl)Cl</obo_purl:chebi/smiles>
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