Enoch, S.J.; Cronin, M.T.D.; Schultz, T.W.; Madden, J.C. An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis. Chemosphere 2008, 71, 7, 1225–1232.
Compound
| ID: | 82 | |
|---|---|---|
| Name: | 3-tert-butylphenol | |
| Description: | ||
| Labels: | ||
| CAS: | 585-34-2 | |
| InChi Code: | InChI=1S/C10H14O/c1-10(2,3)8-5-4-6-9(11)7-8/h4-7,11H,1-3H3 |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mol)] i
| Value | Source or prediction |
|---|---|
| 0.73 |
experimental value |
| 1.1200 |
TabS1: Polar narcotics (Taining set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9044825 | US EPA CompTox Dashboard |