Molecule ID: 22019185

IUPAC Name: 4-methyl-3-oxopentanoate

Description: The molecule is the monocarboxylic acid anion formed from 3-oxo-4-methylpentanoic acid; principal microspecies at pH 7.3. It is a conjugate base of a 4-methyl-3-oxopentanoic acid.

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

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

InChI: InChI=1S/C6H10O3/c1-4(2)5(7)3-6(8)9/h4H,3H2,1-2H3,(H,8,9)/p-1

Molecular Properties:
- Polar Surface Area: 57.2 Ų
- LogP: 1.3