Molecule ID: 25244890

IUPAC Name: (Z)-pent-1-ene-1,2,5-tricarboxylic acid

Description: The molecule is a tricarboxylic acid that consists of pent-1-ene having three carboxy groups located at positions 1, 2 and 5 (the Z-geoisomer). It is a conjugate acid of a cis-dihomoaconitate(3-).

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

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

InChI: InChI=1S/C8H10O6/c9-6(10)3-1-2-5(8(13)14)4-7(11)12/h4H,1-3H2,(H,9,10)(H,11,12)(H,13,14)/b5-4-

Molecular Properties:
- Polar Surface Area: 112.0 Ų
- LogP: -0.3