Molecule ID: 11966251

IUPAC Name: (Z)-2,5-dichloro-4-oxohex-2-enedioate

Description: The molecule is an oxo dicarboxylate obtained by deprotonation of both carboxy groups of 2,5-dichloro-4-oxohex-2-enedioic acid. It derives from a 4-oxohex-2-enedioate. It is a conjugate base of a 2,5-dichloro-4-oxohex-2-enedioic acid.

SMILES: O=C([O-])/C(Cl)=C/C(=O)C(Cl)C(=O)[O-]

SELFIES: [O][=C][Branch1][C][O-1][/C][Branch1][C][Cl][=C][/C][=Branch1][C][=O][C][Branch1][C][Cl][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C6H4Cl2O5/c7-2(5(10)11)1-3(9)4(8)6(12)13/h1,4H,(H,10,11)(H,12,13)/p-2/b2-1-

Molecular Properties:
- Polar Surface Area: 97.3 Ų
- LogP: 2.3