Molecule ID: 21920889

IUPAC Name: 2-ethyl-3-oxopentanoic acid

Description: The molecule is a 3-oxo monocarboxylic acid that is pentanoic acid substituted at positions 2 and 3 by ethyl and oxo substituents respectively.

SMILES: CCC(=O)C(CC)C(=O)O

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

InChI: InChI=1S/C7H12O3/c1-3-5(7(9)10)6(8)4-2/h5H,3-4H2,1-2H3,(H,9,10)

Molecular Properties:
- Polar Surface Area: 54.4 Ų
- LogP: 1.0