CC(=O)C(=O)O
CAS: 127-17-3
Name: 2-oxopropanoic acid
SMILES: CC(=O)C(=O)O

Molecular Processing

Molecular formula
C3H4O3
Molecular weight
88.06
Exact mass
88.016
XLogP
-0.34
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
6
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
0.333
Molar refractivity
18.32

Supplementary Information

InChIKey: LCTONWCANYUPML-UHFFFAOYSA-N
Synonyms
Pyruvic acid2-Oxopropanoic acid127-17-3acetylformic acidPyroracemic acid2-Oxopropionic acidPropanoic acid, 2-oxo-alpha-ketopropionic acid2-Ketopropionic acid2-Oxopropansaeure2-Oxopropionsaeurealpha-Oxopropionsaeure2-oxo-propionic acidacide pyruviquea-Ketopropionic acidCH3COCOOHFEMA No. 2970BrenztraubensaeureDTXSID2021650NSC-1798558G7RUTRDTXCID801650CHEBI:32816Acid, PyruvicRefChem:6190204-824-3Pyruvic acid (natural)alpha-keto propionic acid.alpha.-Ketopropionic acidAI3-11220
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