Molecule ID: 5460320

IUPAC Name: 3-oxododecanoate

Description: The molecule is a 3-oxo fatty acid anion. It derives from a dodecanoate. It is a conjugate base of a 3-oxolauric acid.

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

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

InChI: InChI=1S/C12H22O3/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)15/h2-10H2,1H3,(H,14,15)/p-1

Molecular Properties:
- Polar Surface Area: 57.2 Ų
- LogP: 4.4