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:	1443
	Name:	2,2',3,3',4,4',5,5',6-nonachloro-1,1'-biphenyl
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 2.2'.3.3'.4.4'.5.5'.6-Nonachloro-1.1'-biphenyl
	Labels:
	CAS:	40186-72-9
	InChi Code:	InChI=1S/C12HCl9/c13-3-1-2(5(14)9(18)6(3)15)4-7(16)10(19)12(21)11(20)8(4)17/h1H

Properties

M5.logHLn: Biotransformation half-lives in fish

Value	Source or prediction
2.675825461	experimental value
2.8607	Tab2.Model_5: Metab. biotransf. fish (Training set)