10967/129 - QDB Compounds

QsarDB Repository

Veith, G.D.; Petkova, E.P.; Wallace, K.B. A baseline inhalation toxicity model for narcosis in mammals. SAR QSAR Environ. Res. 2009, 20, 5-6, 567–578.

Compound

ID:10
Name:Acetonitrile
Description:
Labels:
CAS:75-05-8
InChi Code:InChI=1S/C2H3N/c1-2-3/h1H3

Properties

logLC50exp: Acute inhalation toxicity in rats as log(LC50) [log(mmol/m3)]

ValueSource or prediction
2.77

Pozzani, U. C.; Carpenter, C. P.; Palm, P. E.; Weil, C. S.; Nair, J. H. Mammalian toxicity of acetonitrile. Journal of Occupational Medicine 1959, 1, 634-642.

2.89

Eq1: Non-polar narcosis for baseline toxicity in rat acute inhalation (Training set)

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