Molecule ID: 41428

IUPAC Name: 2-(3,5,6-trichloropyridin-2-yl)oxyacetic acid

Description: The molecule is a monocarboxylic acid that is (pyridin-2-yloxy)acetic acid substituted by chloro groups at positions 3, 5 and 6. It is an agrochemical used as a herbicide. It has a role as an environmental contaminant, a xenobiotic, a herbicide and an agrochemical. It is an aromatic ether, a chloropyridine and a monocarboxylic acid.

SMILES: O=C(O)COc1nc(Cl)c(Cl)cc1Cl

SELFIES: [O][=C][Branch1][C][O][C][O][C][=N][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl]

InChI: InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)

Molecular Properties:
- Polar Surface Area: 59.4 Ų
- LogP: 3.0