CHEBI:157631 - 2-hydroxy-2-phenylcyclohexanecarboxylic acid

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ChEBI Name 2-hydroxy-2-phenylcyclohexanecarboxylic acid
ChEBI ID CHEBI:157631
Definition A member of the class of cyclohexanols that is cyclohexane substituted by carboxy, hydroxy and phenyl groups at positions 1, 2 and 2, respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H16O3
Net Charge 0
Average Mass 220.268
Monoisotopic Mass 220.10994
InChI InChI=1S/C13H16O3/c14-12(15)11-8-4-5-9-13(11,16)10-6-2-1-3-7-10/h1-3,6-7,11,16H,4-5,8-9H2,(H,14,15)
InChIKey VCZPUGSOJXZKIP-UHFFFAOYSA-N
SMILES OC(=O)C1CCCCC1(O)C1=CC=CC=C1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-hydroxy-2-phenylcyclohexanecarboxylic acid (CHEBI:157631) is a benzenes (CHEBI:22712)
2-hydroxy-2-phenylcyclohexanecarboxylic acid (CHEBI:157631) is a cyclohexanols (CHEBI:23480)
2-hydroxy-2-phenylcyclohexanecarboxylic acid (CHEBI:157631) is a monocarboxylic acid (CHEBI:25384)
Incoming (1R,2S)-cicloxilic acid (CHEBI:157629) is a 2-hydroxy-2-phenylcyclohexanecarboxylic acid (CHEBI:157631)
(1S,2R)-cicloxilic acid (CHEBI:157630) is a 2-hydroxy-2-phenylcyclohexanecarboxylic acid (CHEBI:157631)
IUPAC Name
2-hydroxy-2-phenylcyclohexanecarboxylic acid
Synonym Source
2-hydroxy-2-phenylcyclohexane-1-carboxylic acid IUPAC
Last Modified
12 October 2020
General Comment
2020-10-12 This is the entry for material with unspecified stereochemistry. There are separate entries for the racemate (cicloxilic acid) and its individual enantiomers, (1R,2S)- and (1S,2R)-cicloxilic acid.