Molecule ID: 54694262

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

Description: The molecule is a methoxybenzoate that is the conjugate base of syringic acid, obtained by deprotonation of the carboxy group. It is a methoxybenzoate and a hydroxybenzoate. It is a conjugate base of a syringic acid.

SMILES: COc1cc(C(=O)O)cc(OC)c1[O-]

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

InChI: InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)/p-1

Molecular Properties:
- Polar Surface Area: 78.8 Ų
- LogP: 1.7