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:107350-42-5
Name:1,2,2,3,3,4,4,5,5,6,6-undecafluoro-N-(2,3,4,5-tetrachlorophenyl)cyclohexane-1-carboxamide
Description:
Labels:
CAS:107350-42-5
InChi Code:InChI=1/C13H2Cl4F11NO/c14-2-1-3(5(16)6(17)4(2)15)29-7(30)8(18)9(19,20)11(23,24)13(27,28)12(25,26)10(8,21)22/h1H,(H,29,30)/f/h29H

Properties

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

ValueSource or prediction
3.14

experimental value

2.9595

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

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