Molecule ID: 16213286

IUPAC Name: 1,1,3,3-tetradeuterio-2-hydroxypropane-1,2,3-tricarboxylic acid

Description: The molecule is a deuterated compound that is citric acid in which the four methylene hydrogens are replaced by deuterium. It is a deuterated compound, a tricarboxylic acid and a tertiary alcohol.

SMILES: [2H]C([2H])(C(=O)O)C(O)(C(=O)O)C([2H])([2H])C(=O)O

SELFIES: [2H][C][Branch1][C][2H][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][2H][Branch1][C][2H][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/i1D2,2D2

Molecular Properties:
- Polar Surface Area: 132.0 Ų
- LogP: -1.7