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Acetoxyacetone

PropertiesImage
MNX_IDMNXM118771 Image of MNXM118771
referencechebi:173422
formulaC5H8O3
global charge0
mol weight116.116
InChIKeyDBERHVIZRVGDFO-UHFFFAOYSA-N
InChIInChI=1S/C5H8O3/c1-4(6)3-8-5(2)7/h3H2,1-2H3
SMILESCC(=O)COC(C)=O
MNX internals
InChI (mnx)InChI=1/C5H8O3/c1-4(6)3-8-5(2)7/h3H2,1-2H3 Image of MNXM118771
SMILES (mnx)[CH3:1][C:4]([CH2:3][O:8][C:5]([CH3:2])=[O:7])=[O:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:173422
chebi:173422
DBERHVIZRVGDFO-UHFFFAOYSA-N
Acetoxyacetone
2-oxopropyl acetate
hmdb:HMDB0034466
DBERHVIZRVGDFO-UHFFFAOYSA-N
Acetoxyacetone
1-(Acetyloxy)-2-propanone
1-Acetoxy-2-propanone
1-Acetoxy-propan-2-one
1-Acetoxyacetone
1-Acetyloxy-propan-2-one
1-Hydroxy-2-propanone acetate
2-Oxopropyl acetate
2-Oxopropyl acetic acid
2-Propanone, 1-hydroxy-, acetate
2-Propanone, 1-hydroxy-, acetate (8ci)
2-oxopropyl acetate
2-propanone, 1-(acetyloxy)-
ACETIC ACID,(2-oxopropyl) ester acetonylacetATE
Acetol acetate
Acetonyl acetate
Acetoxy-2-propanone
Acetoxypropanone
Acetylmethyl acetate
O-Acetylacetol

hmdb:HMDB34466
secondary/obsolete/fantasy identifier