Molecule ID: 25181547

IUPAC Name: 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)pyridine-2-carboxylic acid

Description: The molecule is a pyridinemonocarboxylic acid that is 4-amino-3-chloropyridine-2-carboxylic acid which is substituted by a 4-chloro-2-fluoro-3-methoxyphenyl group at position 6. It is a herbicide used for the control of broad-leaved weeds in cereals and oilseed rape. It has a role as a herbicide, a synthetic auxin and a metabolite. It is a member of monochlorobenzenes, a member of monofluorobenzenes, a monomethoxybenzene, a chloropyridine, an aminopyridine, a pyridinemonocarboxylic acid and a biaryl.

SMILES: COc1c(Cl)ccc(-c2cc(N)c(Cl)c(C(=O)O)n2)c1F

SELFIES: [C][O][C][=C][Branch1][C][Cl][C][=C][C][Branch2][Ring1][=Branch1][C][=C][C][Branch1][C][N][=C][Branch1][C][Cl][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=N][Ring1][O][=C][Ring2][Ring1][C][F]

InChI: InChI=1S/C13H9Cl2FN2O3/c1-21-12-6(14)3-2-5(10(12)16)8-4-7(17)9(15)11(18-8)13(19)20/h2-4H,1H3,(H2,17,18)(H,19,20)

Molecular Properties:
- Polar Surface Area: 85.4 Ų
- LogP: 3.0