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: | E | |
|---|---|---|
| Name: | 2,5-diaminotoluene | |
| Description: | ||
| Labels: | ||
| CAS: | 95-70-5 | |
| InChi Code: | InChI=1S/C7H10N2/c1-5-4-6(8)2-3-7(5)9/h2-4H,8-9H2,1H3 |
Properties
pLC50: 96-h acute fish toxicity as log(1/LC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 2.81 |
experimental value |
| 2.07 |
Eq.3: Model for aromatic amines and phenols (fish) (Validation set) |
pEC50: 72-h acute algae toxicity as log(1/EC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 1.79 |
experimental value |
| 2.59 |
Eq.4: Model for aromatic amines and phenols (algae) (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6029123 | US EPA CompTox Dashboard |