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: | Tab2_6 | |
|---|---|---|
| Name: | 1,4-Benzenediamine, N,N'-bis(1-methylpropyl)- | |
| Description: | ||
| Labels: | ||
| CAS: | 101-96-2 | |
| InChi Code: | InChI=1S/C14H24N2/c1-5-11(3)15-13-7-9-14(10-8-13)16-12(4)6-2/h7-12,15-16H,5-6H2,1-4H3 |
Properties
pEC50: 72-h acute algae toxicity as log(1/EC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 2.37 |
experimental value |
| 2.26 |
Eq.4: Model for aromatic amines and phenols (algae) (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7024956 | US EPA CompTox Dashboard |