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:	1957
	Name:	2,2,3,3-tetrachloro-1,1,1,4,4,4-hexafluorobutane
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 2,2,3,3-Tetrachloro-1,1,1,4,4,4-hexafluorobutane
	Labels:
	CAS:	375-34-8
	InChi Code:	InChI=1S/C4Cl4F6/c5-1(6,3(9,10)11)2(7,8)4(12,13)14

Properties

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

Value	Source or prediction
2.58	experimental value
1.9342	Tab2.Model_14: PFC oral rat LD50 (Training set)

Links to External Resources

Link	Resource description
DTXSID70190947	US EPA CompTox Dashboard