CC(=O)C(=O)OC
CAS: 600-22-6
Nom: methyl 2-oxopropanoate
SMILES: CC(=O)C(=O)OC

Molecular Processing

Molecular formula
C4H6O3
Molecular weight
102.09
Exact mass
102.0317
XLogP
-0.25
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
22.7

Supplementary Information

InChIKey: CWKLZLBVOJRSOM-UHFFFAOYSA-N
Synonymes
METHYL PYRUVATE600-22-6Methyl 2-oxopropanoateMethyl 2-oxopropionatePyruvic acid, methyl esterPropanoic acid, 2-oxo-, methyl esterMethylglyoxylic acid methyl ester2-oxo-propionic acid methyl ester3KJM65G5XLNSC-65430CHEBI:51850RefChem:818068209-987-4MethylpyruvatePyruvic acid methyl estermethyl-PyruvateDTXSID9049326MFCD000087542-oxopropanoic acid methyl esterUNII-3KJM65G5XLEINECS 209-987-4Propanoic acid, 2-oxo-,methyl esterTiapride Intermediatespyruvic acid methylesterMETHYL ACETOFORMATEMETHYL PYRORACEMATEMethyl 2-oxopropanoate #SCHEMBL27432orb3023688QSPL 174
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→