Molecule ID: 7014867

IUPAC Name: 4-(3-carboxylatopropyldisulfanyl)butanoate

Description: The molecule is a dicarboxylic acid dianion resulting from the deprotonation of both of the carboxy groups of 4,4'-disulfanyldibutanoic acid. It is a conjugate base of a 4,4'-disulfanyldibutanoic acid.

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

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

InChI: InChI=1S/C8H14O4S2/c9-7(10)3-1-5-13-14-6-2-4-8(11)12/h1-6H2,(H,9,10)(H,11,12)/p-2

Molecular Properties:
- Polar Surface Area: 131.0 Ų
- LogP: 1.9