Molecule ID: 25767865

IUPAC Name: 3-(1-carboxylatoethenoxy)benzoate

Description: The molecule is a dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of 3-[(1-carboxyvinyl)oxy]benzoic acid; major species at pH 7.3. It is a conjugate base of a 3-[(1-carboxyvinyl)oxy]benzoic acid.

SMILES: C=C(Oc1cccc(C(=O)[O-])c1)C(=O)[O-]

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

InChI: InChI=1S/C10H8O5/c1-6(9(11)12)15-8-4-2-3-7(5-8)10(13)14/h2-5H,1H2,(H,11,12)(H,13,14)/p-2

Molecular Properties:
- Polar Surface Area: 89.5 Ų
- LogP: 2.9