Molecule ID: 25203332

IUPAC Name: 2-(3-methyl-5-oxo-2H-furan-2-yl)acetate

Description: The molecule is a monocarboxylic acid anion that is the conjugate base of 4-carboxymethyl-3-methylbut-2-en-1,4-olide; major species at pH 7.3. It is a conjugate base of a 4-carboxymethyl-3-methylbut-2-en-1,4-olide.

SMILES: CC1=CC(=O)OC1CC(=O)[O-]

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

InChI: InChI=1S/C7H8O4/c1-4-2-7(10)11-5(4)3-6(8)9/h2,5H,3H2,1H3,(H,8,9)/p-1

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 0.3