CHEBI:89263 - 1-Isopropyl-2-methylbenzene

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ChEBI Name 1-Isopropyl-2-methylbenzene ChEBI ID CHEBI:89263 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formulae C10H14 C10H14 Net Charge 0 Average Mass 134.219 Monoisotopic Mass 134.10955 InChI InChI=1S/C10H14/c1-8(2)10-7-5-4-6-9(10)3/h4-8H,1-3H3 InChIKey WWRCMNKATXZARA-UHFFFAOYSA-N SMILES CC(C)C1=CC=CC=C1C Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed ChEBI Ontology Outgoing 1-Isopropyl-2-methylbenzene (CHEBI:89263) is a alkylbenzene (CHEBI:38976) Synonyms Sources 1-(1-Methylethyl)-2-methylbenzene HMDB 1-Methyl,2-N-isopropylbenzene HMDB 1-Methyl-2-(1-methylethyl)-benzene HMDB 1-Methyl-2-(1-methylethyl)-Benzene HMDB 1-Methyl-2-(1-methylethyl)benzene, 9CI HMDB 1-methyl-2-(propan-2-yl)benzene HMDB 1-Methyl-2-isopropylbenzene HMDB 1-Methyl-2-isopropylbenzol HMDB 2-Isopropyltoluene HMDB Cymene, ortho HMDB O-Cymene HMDB O-Cymol HMDB O-Isopropyltoluene HMDB O-Mentha-1,3,5-triene HMDB Ortho-cymene HMDB Manual Xrefs Databases C00010974 KNApSAcK HMDB0037050 HMDB View more database links Registry Number Type Source 527-84-4 CAS Registry Number KEGG COMPOUND Citations Types Sources 19167006 PubMed citation Europe PMC 19772730 PubMed citation Europe PMC 24023812 PubMed citation Europe PMC 24657864 PubMed citation Europe PMC 3979538 PubMed citation Europe PMC Last Modified 19 February 2018