10967/218 - QDB Compounds

QsarDB Repository

Claeys, L.; Iaccino, F.; Janssen, C. R.; Van Sprang, P.; Verdonck, F. Development and validation of a quantitative structure-activity relationship for chronic narcosis to fish. Environ. Toxicol. Chem. 2013, 32, 2217–2225.

Compound

ID:np11
Name:1,1,1-trichloroethane
Description:
Labels:
CAS:71-55-6
InChi Code:InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3

Properties

NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]

ValueSource or prediction
-1.24

experimental value

-1.45

Tab3.Eq1: Nonpolar narcosis (Training set)

-1.448

QMRF1: Nonpolar narcosis (Training set)