Molecule ID: 8129

IUPAC Name: heptan-1-ol

Description: The molecule is an alkyl alcohol that is heptane in which a hydrogen of one of the methyl groups is substituted by a hydroxy group. It has been isolated from Capillipedium parviflorum. It has a role as a plant metabolite, a fragrance and a flavouring agent. It is a primary alcohol, an alkyl alcohol and a volatile organic compound. It derives from a hydride of a heptane.

SMILES: CCCCCCCO

SELFIES: [C][C][C][C][C][C][C][O]

InChI: InChI=1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 2.7