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:np82
Name:1,2-dimethylbenzene
Description:
Labels:
CAS:95-47-6
InChi Code:InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3

Properties

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

ValueSource or prediction
-1.72

experimental value

-2.04

QMRF1: Nonpolar narcosis (Training set)