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:	1973
	Name:	4-(1,1,2,2-tetrafluoroethoxy)benzene-1,3-diamine
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 4-(1,1,2,2-tetrafluoroethoxy)benzene-1,3-diamine
	Labels:
	CAS:	61988-37-2
	InChi Code:	InChI=1S/C8H8F4N2O/c9-7(10)8(11,12)15-6-2-1-4(13)3-5(6)14/h1-3,7H,13-14H2

Properties

M14.pLD50: Acute oral toxicity in rat as log(1/LD50) [-log(mmol/kg)] i

Value	Source or prediction
2.321	experimental value
1.63	Tab2.Model_14: PFC oral rat LD50 (Training set)

Links to External Resources

Link	Resource description
DTXSID90211022	US EPA CompTox Dashboard