Molecule ID: 54694265

IUPAC Name: 4-carboxy-2,6-dichlorophenolate

Description: The molecule is the conjugate base of 3,5-dichlorohydroxybenzoic acid. Comprising a 3,5-dihydroxybenzoic acid core with the carboxylic acid proton missing, giving a charge of -1. It derives from a benzoate. It is a conjugate base of a 3,5-dichloro-4-hydroxybenzoic acid.

SMILES: O=C(O)c1cc(Cl)c([O-])c(Cl)c1

SELFIES: [O][=C][Branch1][C][O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][O-1][C][Branch1][C][Cl][=C][Ring1][=Branch2]

InChI: InChI=1S/C7H4Cl2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)/p-1

Molecular Properties:
- Polar Surface Area: 60.4 Ų
- LogP: 3.0