Molecule ID: 25202344

IUPAC Name: 16-oxohexadecanoate

Description: The molecule is an omega-oxo fatty acid anion that is the conjugate base of 16-oxohexadecanoic acid, arising from the deprotonation of the carboxy group; major species at pH 7.3. It is an omega-oxo fatty acid anion, an aldehydic acid anion and a long-chain fatty acid anion. It is a conjugate base of a 16-oxohexadecanoic acid.

SMILES: O=CCCCCCCCCCCCCCCC(=O)[O-]

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

InChI: InChI=1S/C16H30O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h15H,1-14H2,(H,18,19)/p-1

Molecular Properties:
- Polar Surface Area: 57.2 Ų
- LogP: 5.9