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> Main
CHEBI:149767 - 1-hydroxy-1-phenylpropan-2-one
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ChEBI Name
1-hydroxy-1-phenylpropan-2-one
ChEBI ID
CHEBI:149767
Definition
A secondary α-hydroxy ketone that is benzene which is substituted by a 1-hydroxy-2-oxopropyl group at position 1.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C9H10O2
Net Charge
0
Average Mass
150.177
Monoisotopic Mass
150.06808
InChI
InChI=1S/C9H10O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6,9,11H,1H3
InChIKey
ZBFFNPODXBJBPW-UHFFFAOYSA-N
SMILES
C=1C=CC=CC1C(C(C)=O)O
ChEBI Ontology
Outgoing
1-hydroxy-1-phenylpropan-2-one (
CHEBI:149767
)
is a
benzenes (
CHEBI:22712
)
1-hydroxy-1-phenylpropan-2-one (
CHEBI:149767
)
is a
methyl ketone (
CHEBI:51867
)
1-hydroxy-1-phenylpropan-2-one (
CHEBI:149767
)
is a
secondary α-hydroxy ketone (
CHEBI:2468
)
Incoming
(
R
)-phenylacetylcarbinol (
CHEBI:149671
)
is a
1-hydroxy-1-phenylpropan-2-one (
CHEBI:149767
)
(
S
)-phenylacetylcarbinol (
CHEBI:149670
)
is a
1-hydroxy-1-phenylpropan-2-one (
CHEBI:149767
)
IUPAC Name
1-hydroxy-1-phenylpropan-2-one
Synonyms
Sources
1-hydroxy-1-phenyl-2-propanone
ChEBI
1-hydroxy-1-phenylacetone
ChEBI
1-phenylacetylcarbinol
ChEBI
phenylacetylcarbinol
ChEBI
Citation
Type
Source
IND606212396
Agricola citation
Europe PMC
Last Modified
18 May 2020
General Comment
2020-05-18
This is the entry for unspecified stereochemistry. There are separate entries fro the racemate (
rac
-phenylacetylcarbinol) and its individual enatiomers, (
R
)- and (
S
)-phenylacetylcarbinol.