Molecule ID: 22275672

IUPAC Name: 5-hydroxyhexanoate

Description: The molecule is an (omega-1)-hydroxy fatty acid that is the conjugate base of 5-hydroxyhexanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is an (omega-1)-hydroxy fatty acid anion, a medium-chain fatty acid anion and a hydroxy saturated fatty acid anion. It is a conjugate base of a 5-hydroxyhexanoic acid.

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

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

InChI: InChI=1S/C6H12O3/c1-5(7)3-2-4-6(8)9/h5,7H,2-4H2,1H3,(H,8,9)/p-1

Molecular Properties:
- Polar Surface Area: 60.4 Ų
- LogP: 0.8