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_51 | |
|---|---|---|
| Name: | 2,6-Di-sec-butylphenol | |
| Description: | ||
| Labels: | ||
| CAS: | 5510-99-6 | |
| InChi Code: | InChI=1S/C14H22O/c1-5-10(3)12-8-7-9-13(14(12)15)11(4)6-2/h7-11,15H,5-6H2,1-4H3 |
Properties
pEC50: 72-h acute algae toxicity as log(1/EC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 2.27 |
experimental value |
| 2.03 |
Eq.4: Model for aromatic amines and phenols (algae) (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0044440 | US EPA CompTox Dashboard |