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:042818-60-0
Name:1-[3-amino-5-(trifluoromethyl)phenyl]ethanol
Description:
Labels:
CAS:42818-60-0
InChi Code:InChI=1/C9H10F3NO/c1-5(14)6-2-7(9(10,11)12)4-8(13)3-6/h2-5,14H,13H2,1H3

Properties

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

ValueSource or prediction
2.34

experimental value

2.70715

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