10967/179 - QDB Compounds

QsarDB Repository

Bhhatarai, B.; Gramatica, P. Per- and Polyfluoro Toxicity (LC 50 Inhalation) Study in Rat and Mouse Using QSAR Modeling. Chem. Res. Toxicol. 2010, 23, 528–539.

Compound

ID:000382-10-5
Name:3,3,3-trifluoro-2-(trifluoromethyl)prop-1-ene
Description:The original non-IUPAC name was: 3,3,3,4,4,4-Hexafluoroisobutylene
Labels:
CAS:382-10-5
InChi Code:InChI=1S/C4H2F6/c1-2(3(5,6)7)4(8,9)10/h1H2

Properties

pLC50rat: Rat acute inhalation toxicity as pLC50 [-log(mmol/m^3)]

ValueSource or prediction
2.0612

experimental value

2.40649

Eq2: Acute inhalation toxicity in rats of perfluorinated compounds. (Training set)

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