Molecule ID: 8892

IUPAC Name: hexanoic acid

Description: The molecule is a C6, straight-chain saturated fatty acid. It has a role as a human metabolite and a plant metabolite. It is a straight-chain saturated fatty acid and a medium-chain fatty acid. It is a conjugate acid of a hexanoate.

SMILES: CCCCCC(=O)O

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

InChI: InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 1.9