Molecule ID: 25203672

IUPAC Name: 6-methyl-3,4-dioxocyclohexa-1,5-dien-1-olate

Description: The molecule is an organic anion obtained by deprotonation of the hydroxy group of 2-hydroxy-5-methylquinone. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). It is a conjugate base of a 2-hydroxy-5-methylquinone.

SMILES: CC1=CC(=O)C(=O)C=C1[O-]

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

InChI: InChI=1S/C7H6O3/c1-4-2-6(9)7(10)3-5(4)8/h2-3,8H,1H3/p-1

Molecular Properties:
- Polar Surface Area: 57.2 Ų
- LogP: 0.3