Molecule ID: 10459

IUPAC Name: hexadecanedioic acid

Description: The molecule is an alpha,omega-dicarboxylic acid that is the 1,14-dicarboxy derivative of tetradecane. It has a role as a human metabolite. It is a conjugate acid of a hexadecanedioate(2-).

SMILES: O=C(O)CCCCCCCCCCCCCCC(=O)O

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

InChI: InChI=1S/C16H30O4/c17-15(18)13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)20/h1-14H2,(H,17,18)(H,19,20)

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 5.4