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:000431-46-9
Name:Trifluoroacetaldehyde methyl hemiacetal
Description:
Labels:
CAS:431-46-9
InChi Code:InChI=1/C3H5F3O2/c1-8-2(7)3(4,5)6/h2,7H,1H3

Properties

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

ValueSource or prediction
2.37

experimental value

1.65875

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