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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:88390 - 1-hydroxybutan-2-one
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ChEBI Name
1-hydroxybutan-2-one
ChEBI ID
CHEBI:88390
Definition
A primary α-hydroxy ketone that is butane-1,2-diol in which the hydroxy group at position 2 has been formally oxidised to give the corresponding ketone.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C4H8O2
Net Charge
0
Average Mass
88.105
Monoisotopic Mass
88.05243
InChI
InChI=1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3
InChIKey
GFAZHVHNLUBROE-UHFFFAOYSA-N
SMILES
CCC(CO)=O
ChEBI Ontology
Outgoing
1-hydroxybutan-2-one (
CHEBI:88390
)
has functional parent
butan-2-one (
CHEBI:28398
)
1-hydroxybutan-2-one (
CHEBI:88390
)
has functional parent
butane-1,2-diol (
CHEBI:52682
)
1-hydroxybutan-2-one (
CHEBI:88390
)
is a
primary α-hydroxy ketone (
CHEBI:139590
)
IUPAC Name
1-hydroxybutan-2-one
Synonyms
Sources
1-hydroxy-2-butanone
UniProt
1-hydroxy-2-butanone
ChemIDplus
2-oxobutanol
ChemIDplus
ethyl hydroxymethyl ketone
ChemIDplus
FEMA 3173
HMDB
FEMA No. 3173
ChemIDplus
Manual Xref
Database
FDB008098
FooDB
View more database links
Registry Numbers
Types
Sources
506105
Reaxys Registry Number
Reaxys
5077-67-8
CAS Registry Number
NIST Chemistry WebBook
5077-67-8
CAS Registry Number
ChemIDplus
Last Modified
07 February 2018