Molecule ID: 25244229

IUPAC Name: (Z)-hex-1-ene-1,2,6-tricarboxylic acid

Description: The molecule is a tricarboxylic acid that consists of hex-1-ene having three carboxy groups located at positions 1, 2 and 6 (the Z-geoisomer). It is a conjugate acid of a cis-trihomoaconitate(3-).

SMILES: O=C(O)/C=C(/CCCCC(=O)O)C(=O)O

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

InChI: InChI=1S/C9H12O6/c10-7(11)4-2-1-3-6(9(14)15)5-8(12)13/h5H,1-4H2,(H,10,11)(H,12,13)(H,14,15)/b6-5-

Molecular Properties:
- Polar Surface Area: 112.0 Ų
- LogP: 0.2