10967/221 - QDB Compounds

QsarDB Repository

Bajot, F.; Cronin, M. Polar narcosis QSAR for fathead minnow acute toxicity. Q17-33-0032. Liverpool John Moores University, 2009.

Compound

ID:4
Name:2,3,6-Trimethylphenol
Description:
Labels:
CAS:2416-94-6
InChi Code:InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3

Properties

pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]

ValueSource or prediction
-1.78

experimental value

-1.54

QSAR: Polar narcosis (Training set)