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:000378-75-6
Name:methyl 2,2,3,3,3-pentafluoropropanoate
Description:The original non-IUPAC name was: Propanoic acid, 2,2,3,3,3-pentafluoro-, methyl ester
Labels:
CAS:378-75-6
InChi Code:InChI=1S/C4H3F5O2/c1-11-2(10)3(5,6)4(7,8)9/h1H3

Properties

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

ValueSource or prediction
3.889

experimental value

4.13883

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