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_37 | |
|---|---|---|
| Name: | Benzoic acid, 3,5-bis(1,1-dimethylethyl)-2-hydroxy- | |
| Description: | ||
| Labels: | ||
| CAS: | 19715-19-6 | |
| InChi Code: | InChI=1S/C15H22O3/c1-14(2,3)9-7-10(13(17)18)12(16)11(8-9)15(4,5)6/h7-8,16H,1-6H3,(H,17,18) |
Properties
pEC50: 72-h acute algae toxicity as log(1/EC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| 1.57 |
experimental value |
| 1.96 |
Eq.4: Model for aromatic amines and phenols (algae) (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2066519 | US EPA CompTox Dashboard |