Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

	ID:	1310
	Name:	O-2-chloro-4-nitrophenyl O,O-dimethyl phosphorothioate
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Dicapthon The representation of nitro groups was fixed
	Labels:
	CAS:	2463-84-5
	InChi Code:	InChI=1S/C8H9ClNO5PS/c1-13-16(17,14-2)15-8-4-3-6(10(11)12)5-7(8)9/h3-5H,1-2H3

Properties

M5.logHLn: Biotransformation half-lives in fish

Value	Source or prediction
0.010825461	experimental value
0.2546	Tab2.Model_5: Metab. biotransf. fish (Training set)