Molecule ID: 25201324

IUPAC Name: 2-methyl-6-oxopyran-4-olate

Description: The molecule is conjugate base of triacetate lactone arising from deprotonation of the 4-hydroxy group; major species at pH 7.3. It is a conjugate base of a triacetate lactone.

SMILES: Cc1cc([O-])cc(=O)o1

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

InChI: InChI=1S/C6H6O3/c1-4-2-5(7)3-6(8)9-4/h2-3,7H,1H3/p-1

Molecular Properties:
- Polar Surface Area: 49.4 Ų
- LogP: 1.2