10967/179 - QDB Compounds

QsarDB Repository

Bhhatarai, B.; Gramatica, P. Per- and Polyfluoro Toxicity (LC 50 Inhalation) Study in Rat and Mouse Using QSAR Modeling. Chem. Res. Toxicol. 2010, 23, 528–539.

Compound

ID:000306-83-2
Name:2,2-dichloro-1,1,1-trifluoroethane
Description:The original non-IUPAC name was: HCFC 123
Labels:
CAS:306-83-2
InChi Code:InChI=1S/C2HCl2F3/c3-1(4)2(5,6)7/h1H

Properties

pLC50mouse: Mice acute inhalation toxicity as pLC50 [-log(mmol/m^3)]

ValueSource or prediction
0.315

experimental value

1.43893

Eq1: Acute inhalation toxicity in mice of perfluorinated compounds (Training set)

pLC50rat: Rat acute inhalation toxicity as pLC50 [-log(mmol/m^3)]

ValueSource or prediction
0.6793

experimental value

0.05724

Eq2: Acute inhalation toxicity in rats of perfluorinated compounds. (Training set)

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