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:	1445
	Name:	2,7-bis(propan-2-yl)naphthalene
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 2.7-diisopropyl naphthalene
	Labels:
	CAS:	40458-98-8
	InChi Code:	InChI=1S/C16H20/c1-11(2)14-7-5-13-6-8-15(12(3)4)10-16(13)9-14/h5-12H,1-4H3

Properties

M5.logHLn: Biotransformation half-lives in fish

Value	Source or prediction
0.325825461	experimental value
0.7551	Tab2.Model_5: Metab. biotransf. fish (Training set)