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: | 54 | |
|---|---|---|
| Name: | 2,3,6-trimethylphenol | |
| Description: | ||
| Labels: | ||
| CAS: | 2416-94-6 | |
| InChi Code: | InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3 |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mol)] i
| Value | Source or prediction |
|---|---|
| 0.28 |
experimental value |
| 0.9529 |
TabS1: Polar narcotics (Taining set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6022187 | US EPA CompTox Dashboard |