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: | np135 | |
|---|---|---|
| Name: | octane | |
| Description: | ||
| Labels: | ||
| CAS: | 111-65-9 | |
| InChi Code: | InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3 |
Properties
NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]
| Value | Source or prediction |
|---|---|
| -3.61 |
experimental value |
| -3.979 |
Tab3.Eq1: Nonpolar narcosis (Test set) |
| -3.976 |
QMRF1: Nonpolar narcosis (Test set) |