Netzeva, T.I.; Aptula, A.O.; Chaudary, S.H.; Duffy, J.C.; Schultz, T.W.; Schüürmann, G.; Cronin, M.T.D. Structure-Activity Relationships for the Toxicity of Substituted Poly-hydroxylated Benzenes to Tetrahymena pyriformis: Influence of Free Radical Formation. QSAR Comb. Sci. 2003, 22, 6, 575–582.
Compound
| ID: | 26 | |
|---|---|---|
| Name: | 3,5-di(tert)butylcatechol | |
| Description: | ||
| Labels: | ||
| CAS: | 1020-31-1 | |
| InChi Code: |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| 2.109 |
experimental value |
| 2.295 |
1: All benzenes (Training) |
| 2.443 |
2: Selected benzenes (Training) |
| 1.695 |
3: All benzenes (Training) |
| 1.925 |
4: Selected benzenes (Training) |