Molecule ID: 10130039

IUPAC Name: 3-methyl-3-sulfanylhexan-1-ol

Description: The molecule is a primary alcohol that is hexan-1-ol which is substituted by a methyl group and a thiol group at position 3. It is the odor component of human axilla sweat and the major species at pH 7.3. It has a role as a human metabolite. It is a thiol, a primary alcohol and a volatile organic compound. It derives from a hexan-1-ol.

SMILES: CCCC(C)(S)CCO

SELFIES: [C][C][C][C][Branch1][C][C][Branch1][C][S][C][C][O]

InChI: InChI=1S/C7H16OS/c1-3-4-7(2,9)5-6-8/h8-9H,3-6H2,1-2H3

Molecular Properties:
- Polar Surface Area: 21.2 Ų
- LogP: 1.7