Molecule ID: 57339282

IUPAC Name: (3E)-3-(4-hydroxycyclohex-2-en-1-ylidene)-2-oxopropanoic acid

Description: The molecule is a 2-oxo monocarboxylic acid that is pyruvic acid substituted at position 3 by a 4-hydroxycyclohex-2-en-1-ylidene group It is a 2-oxo monocarboxylic acid and a secondary alcohol. It derives from a pyruvic acid. It is a conjugate acid of a 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate.

SMILES: O=C(O)C(=O)/C=C1/C=CC(O)CC1

SELFIES: [O][=C][Branch1][C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][Branch1][C][O][C][C][Ring1][#Branch1]

InChI: InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,5,7,10H,2,4H2,(H,12,13)/b6-5-

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 0.1