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:	1881
	Name:	1,2-dibromo-1,1,2,2-tetrafluoroethane
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 1,2-dibromotetrafluoroethane
	Labels:
	CAS:	124-73-2
	InChi Code:	InChI=1S/C2Br2F4/c3-1(5,6)2(4,7)8

M12.pLC50: Acute inhalation toxicity in mice as log(1/LC50) [-log(mmol/m^3)] i

Value	Source or prediction
2.938	experimental value
3.7891	Tab2.Model_12: PFC inal. mouse LC50 (Training set)

M13.pLC50: Acute inhalation toxicity in rat as log(1/LC50) [-log(mmol/m^3)] i

Value	Source or prediction
2.6483	experimental value
1.7682	Tab2.Model_13: PFC inal. rat LC50 (Training set)

M15.logSw: Water solubility as log(Sw) [log(mg/L)]

Value	Source or prediction
0.48	experimental value
0.5696	Tab2.Model_15: PFC solubility in water (Training set)

M16.logVP: Vapor pressure as log(VP) [log(mm Hg)]

Value	Source or prediction
2.512	experimental value
3.6548	Tab2.Model_16: PFC vapor pressure (Training set)

Link	Resource description
DTXSID0041226	US EPA CompTox Dashboard