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:np141
Name:2-butoxyethanol
Description:
Labels:
CAS:111-76-2
InChi Code:InChI=1S/C6H14O2/c1-2-3-5-8-6-4-7/h7H,2-6H2,1H3

Properties

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

ValueSource or prediction
-0.673942

experimental value

0.111

Tab3.Eq1: Nonpolar narcosis (Test set)

0.113

QMRF1: Nonpolar narcosis (Test set)