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: | np21 | |
|---|---|---|
| Name: | methyl ethyl ketone | |
| Description: | ||
| Labels: | ||
| CAS: | 78-93-3 | |
| InChi Code: | InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3 |
Properties
NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 0.142 |
experimental value |
| 0.618 |
Tab3.Eq1: Nonpolar narcosis (Training set) |
| 0.62 |
QMRF1: Nonpolar narcosis (Training set) |