Molecule ID: 20287221

IUPAC Name: 2-oxoheptanedioate

Description: The molecule is an oxo dicarboxylate obtained by deprotonation of both carboxy groups of 2-oxopimelic acid; major structure at pH 7.3. It derives from a pimelate(2-). It is a conjugate base of a 2-oxopimelic acid.

SMILES: O=C([O-])CCCCC(=O)C(=O)[O-]

SELFIES: [O][=C][Branch1][C][O-1][C][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)/p-2

Molecular Properties:
- Polar Surface Area: 97.3 Ų
- LogP: 1.1