Pérez-Garrido, A.; Helguera, A. M.; López, G. C.; Cordeiro, M. N. D. S.; Escudero, A. G. A topological substructural molecular design approach for predicting mutagenesis end-points of α, β-unsaturated carbonyl compounds. Toxicology 2010, 268, 64–77.
Compound
| ID: | 165 | |
|---|---|---|
| Name: | 2,2,4,5-tetrachlorocyclopentene-1,3-dione | |
| Description: | ||
| Labels: | ||
| CAS: | 15743-13-2 | |
| InChi Code: | InChI=1S/C5Cl4O2/c6-1-2(7)4(11)5(8,9)3(1)10 |
Properties
AMES: Ames test mutagenicity class
| Value | Source or prediction |
|---|---|
| non-mutagen |
experimental value |
| non-mutagen |
Eq6: Model for α,β-unsaturated carbonyl compounds (Training set) |