Molecule ID: 5280595

IUPAC Name: (Z)-5-oxohex-2-enedioic acid

Description: The molecule is an oxo dicarboxylic acid that is (Z)-2-hexenedioic acid in which the hydrogens at position 5 are substituted by an oxo group. It derives from a 2-hexenedioic acid. It is a conjugate acid of a (Z)-5-oxohex-2-enedioate.

SMILES: O=C(O)/C=C\CC(=O)C(=O)O

SELFIES: [O][=C][Branch1][C][O][/C][=C][\C][C][=Branch1][C][=O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H6O5/c7-4(6(10)11)2-1-3-5(8)9/h1,3H,2H2,(H,8,9)(H,10,11)/b3-1-

Molecular Properties:
- Polar Surface Area: 91.7 Ų
- LogP: -0.4