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Details

Stereochemistry ACHIRAL
Molecular Formula C4H8O2
Molecular Weight 88.1051
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-HYDROXY-2-BUTANONE

SMILES

CCC(=O)CO

InChI

InChIKey=GFAZHVHNLUBROE-UHFFFAOYSA-N
InChI=1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3

HIDE SMILES / InChI

Molecular Formula C4H8O2
Molecular Weight 88.1051
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
In vitro metabolism of chloroprene: species differences, epoxide stereochemistry and a de-chlorination pathway.
2001 Nov
Modification of fatty acids changes the flavor volatiles in tomato leaves.
2001 Sep
Stereoselective oxidation of aliphatic diols and reduction of hydroxy-ketones with galactitol dehydrogenase from Rhodobacter sphaeroides D.
2003
Characterization of the beta-carbon processing reactions of the mammalian cytosolic fatty acid synthase: role of the central core.
2004 Aug 17
Protonation thermochemistry of selected hydroxy- and methoxycarbonyl molecules.
2005 Dec 29
D-Fructose-6-phosphate aldolase-catalyzed one-pot synthesis of iminocyclitols.
2007 Nov 28
Ethyl 2-(2-oxo-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)acetate.
2010 Jul 21
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:19:38 UTC 2023
Edited
by admin
on Fri Dec 15 19:19:38 UTC 2023
Record UNII
M57N50D82D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-HYDROXY-2-BUTANONE
FHFI  
Systematic Name English
ETHYL HYDROXYMETHYL KETONE
Systematic Name English
PROPIONYL CARBINOL
Systematic Name English
2-OXO-1-BUTANOL
Systematic Name English
2-BUTANONE, 1-HYDROXY-
Systematic Name English
1-HYDROXY-2-BUTANONE [FHFI]
Common Name English
2-OXOBUTANOL
Systematic Name English
FEMA NO. 3173
Code English
1-HYDROXYBUTAN-2-ONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 1-HYDROXY-2-BUTANONE
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
Code System Code Type Description
MESH
C487002
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
PUBCHEM
521300
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID1063693
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
JECFA MONOGRAPH
1701
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
CAS
5077-67-8
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
CHEBI
88390
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
ECHA (EC/EINECS)
225-790-6
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
FDA UNII
M57N50D82D
Created by admin on Fri Dec 15 19:19:38 UTC 2023 , Edited by admin on Fri Dec 15 19:19:38 UTC 2023
PRIMARY
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