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:039660-55-4
Name:Octafluoro-1-pentanol
Description:
Labels:
CAS:39660-55-4
InChi Code:InChI=1/C5H4F8O/c1-2(6,7)3(8,9)4(10,11)5(12,13)14/h14H,1H3

Properties

pLD50rat: Rat oral toxicity as log(1/LD50) [-log(mmol/kg)]

ValueSource or prediction
2.32

experimental value

1.983321

Eq2: model for 50 polyflourinated compounds for rat oral toxicity (train)