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:	1860
	Name:	2,6-bis(propan-2-yl)aniline
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 2,6-Diisopropylaniline
	Labels:
	CAS:	24544-04-5
	InChi Code:	InChI=1S/C12H19N/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9H,13H2,1-4H3

Properties

M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]

Value	Source or prediction
4.06	experimental value
4.4518	Tab2.Model_1: P. promelas LC50 (Training set)