Schultz, T.W.; Netzeva, T.I.; Roberts, D.W.; Cronin, M.T.D. Structure-Toxicity Relationships for the Effects to Tetrahymena pyriformis of Aliphatic, Carbonyl-Containing, α,β-Unsaturated Chemicals. Chem. Res. Toxicol. 2005, 18, 2, 330–341.
Compound
| ID: | 1 | |
|---|---|---|
| Name: | trans-2-methyl-2-butenal | |
| Description: | ||
| Labels: | ||
| CAS: | 497-03-0 | |
| InChi Code: |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| -0.139 |
experimental value |
| -0.494 |
1: Aliphatic compounds (Training) |
| 0.768 |
2: α,β-unsaturated aldehydes (Training) |
| 0.525 |
3: α,β-unsaturated aldehydes (Training) |
| 0.945 |
4: α,β-unsaturated aldehydes (Training) |