Furuhama, A.; Hasunuma, K.; Aoki, Y. Interspecies quantitative structure–activity–activity relationships (QSAARs) for prediction of acute aquatic toxicity of aromatic amines and phenols. SAR QSAR Environ. Res. 2015, 26, 301–323.
Compound
| ID: | Tab1_45 | |
|---|---|---|
| Name: | 4,4'-(1,3-Phenylenebis(oxy)bisbenzenamine) | |
| Description: | ||
| Labels: | ||
| CAS: | 2479-46-1 | |
| InChi Code: | InChI=1S/C18H16N2O2/c19-13-4-8-15(9-5-13)21-17-2-1-3-18(12-17)22-16-10-6-14(20)7-11-16/h1-12H,19-20H2 |
Properties
pLC50: 96-h acute fish toxicity as log(1/LC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 2.19 |
experimental value |
| 1.78 |
Eq.3: Model for aromatic amines and phenols (fish) (Training set) |