CHEBI:38506 - 2-isopropylphenol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-isopropylphenol
ChEBI ID CHEBI:38506
Definition A member of the class of phenols carrying an isopropyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H12O
Net Charge 0
Average Mass 136.19098
Monoisotopic Mass 136.08882
InChI InChI=1S/C9H12O/c1-7(2)8-5-3-4-6-9(8)10/h3-7,10H,1-2H3
InChIKey CRBJBYGJVIBWIY-UHFFFAOYSA-N
SMILES CC(C)c1ccccc1O
ChEBI Ontology
Outgoing 2-isopropylphenol (CHEBI:38506) has parent hydride cumene (CHEBI:34656)
2-isopropylphenol (CHEBI:38506) is a phenols (CHEBI:33853)
Incoming isoprocarb (CHEBI:38505) has functional parent 2-isopropylphenol (CHEBI:38506)
IUPAC Name
2-(propan-2-yl)phenol
Synonyms Sources
1-Hydroxy-2-isopropylbenzene ChemIDplus
2-(1-Methylethyl)phenol ChemIDplus
2-isopropylphenol UniProt
o-Cumenol ChemIDplus
o-Hydroxycumene ChemIDplus
o-Isopropylphenol ChemIDplus
Manual Xrefs Databases
CPD-14150 MetaCyc
HMDB0032029 HMDB
View more database links
Registry Numbers Types Sources
1363322 Reaxys Registry Number Reaxys
1363322 Beilstein Registry Number Beilstein
88-69-7 CAS Registry Number NIST Chemistry WebBook
88-69-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
14758593 PubMed citation Europe PMC
7811094 PubMed citation Europe PMC
IND92001800 Agricola citation Europe PMC
Last Modified
26 March 2020