CHEBI:167172 - 4-isopropylphenol

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ChEBI Name 4-isopropylphenol
ChEBI ID CHEBI:167172
Definition A member of the class of phenols that is phenol which is carrying an isopropyl group at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Elisabeth COUDERT
Supplier Information
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Formula C9H12O
Net Charge 0
Average Mass 136.194
Monoisotopic Mass 136.08882
InChI InChI=1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3
InChIKey YQUQWHNMBPIWGK-UHFFFAOYSA-N
SMILES CC(C)C1=CC=C(O)C=C1
Roles Classification
Biological Role(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
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ChEBI Ontology
Outgoing 4-isopropylphenol (CHEBI:167172) has parent hydride cumene (CHEBI:34656)
4-isopropylphenol (CHEBI:167172) has role flavouring agent (CHEBI:35617)
4-isopropylphenol (CHEBI:167172) is a phenols (CHEBI:33853)
Incoming 4-isopropylphenyl sulfate (CHEBI:167180) has functional parent 4-isopropylphenol (CHEBI:167172)
IUPAC Name
4-(propan-2-yl)phenol
Synonyms Sources
1-hydroxy-4-isopropylbenzene ChemIDplus
4-(1-methylethyl)phenol ChemIDplus
4-hydroxycumene ChEBI
4-isopropylphenol UniProt
p-cumenol ChemIDplus
p-hydroxycumene ChEBI
p-isopropylphenol ChemIDplus
Manual Xrefs Databases
7185 ChemSpider
FDB005302 FooDB
HMDB0031446 HMDB
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Registry Numbers Types Sources
1363564 Reaxys Registry Number Reaxys
99-89-8 CAS Registry Number NIST Chemistry WebBook
99-89-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
16567400 PubMed citation SUBMITTER
26219367 PubMed citation Europe PMC
27486708 PubMed citation Europe PMC
29225186 PubMed citation Europe PMC
30519707 PubMed citation Europe PMC
32970353 PubMed citation Europe PMC
Last Modified
08 January 2021