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:	1317
	Name:	3,5-di-tert-butyl-[1,1'-biphenyl]-4-ol
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: [1.1 -Biphenyl]-4-ol. 3.5-bis(1.1-dimethylethyl)-
	Labels:
	CAS:	2668-47-5
	InChi Code:	InChI=1S/C20H26O/c1-19(2,3)16-12-15(14-10-8-7-9-11-14)13-17(18(16)21)20(4,5)6/h7-13,21H,1-6H3

Properties

M5.logHLn: Biotransformation half-lives in fish

Value	Source or prediction
1.160825461	experimental value
0.2463	Tab2.Model_5: Metab. biotransf. fish (Training set)