Molecule ID: 12046

IUPAC Name: 2-methylpentanedioic acid

Description: The molecule is an alpha,omega-dicarboxylic acid that is glutaric acid substituted at position 2 by a methyl group. It has a role as a mammalian metabolite. It derives from a glutaric acid. It is a conjugate acid of a 2-methylglutarate(2-).

SMILES: CC(CCC(=O)O)C(=O)O

SELFIES: [C][C][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H10O4/c1-4(6(9)10)2-3-5(7)8/h4H,2-3H2,1H3,(H,7,8)(H,9,10)

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