10967/170 - QDB Compounds

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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:105923-30-6
Name:N-(2-Bromo-4-nitrophenyl)-2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanamide
Description:
Labels:
CAS:105923-30-6
InChi Code:InChI=1/C10H4BrF7N2O3/c11-5-3-4(20(22)23)1-2-6(5)19-7(21)8(12,9(13,14)15)10(16,17)18/h1-3H,(H,19,21)/f/h19H

Properties

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

ValueSource or prediction
3.96

experimental value

4.1794

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

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