Molecule ID: 196

IUPAC Name: hexanedioic acid

Description: The molecule is an alpha,omega-dicarboxylic acid that is the 1,4-dicarboxy derivative of butane. It has a role as a food acidity regulator and a human xenobiotic metabolite. It is a conjugate acid of an adipate(1-).

SMILES: O=C(O)CCCCC(=O)O

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

InChI: InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 0.1