Molecule ID: 12681

IUPAC Name: 2,2-dimethylpentanedioic acid

Description: The molecule is an alpha,omega-dicarboxylic acid that is pentanedioic acid with two methyl groups substituted at position C-2. It has a role as a metabolite.

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

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

InChI: InChI=1S/C7H12O4/c1-7(2,6(10)11)4-3-5(8)9/h3-4H2,1-2H3,(H,8,9)(H,10,11)

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 0.7