10967/170 - QDB Compounds

QsarDB Repository

Bhhatarai, B.; Gramatica, P. Oral LD50 toxicity modeling and prediction of per- and polyfluorinated chemicals on rat and mouse. Mol. Diversity 2010, 15, 467–476.

Compound

ID:000382-93-4
Name:methyl 2,3,3,3-tetrafluoropropanoate
Description:
Labels:
CAS:382-93-4
InChi Code:InChI=1/C4H4F4O2/c1-10-3(9)2(5)4(6,7)8/h2H,1H3

Properties

pLD50mouse: Mouse oral toxicity as log(LD50) [-log(mmol/kg)]

ValueSource or prediction
1.2

experimental value

1.62935

Eq1: model for 58 polyfluorinated compounds for mouse oral toxicity (train)