Molecule ID: 137700802

IUPAC Name: 3,6-dichloro-5-hydroxy-1H-pyridin-2-one

Description: The molecule is a hydroxypyridine that is pyridine substituted by hydroxy groups at positions 2 and 5 and chloro groups at positions 3 and 6. It is a metabolite of the agrochemical chlorpyrifos. It has a role as a bacterial xenobiotic metabolite. It is a chloropyridine and a hydroxypyridine. It is a conjugate acid of a 3,6-dichloropyridine-2,5-diol(1-).

SMILES: Oc1cc(Cl)c(O)nc1Cl

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

InChI: InChI=1S/C5H3Cl2NO2/c6-2-1-3(9)4(7)8-5(2)10/h1,9H,(H,8,10)

Molecular Properties:
- Polar Surface Area: 49.3 Ų
- LogP: 2.2