Papa, E.; Gramatica, P. QSPR as a support for the EU REACH regulation and rational design of environmentally safer chemicals: PBT identification from molecular structure. Green Chem. 2010, 12, 836-843.
Compound
| ID: | 41 | |
|---|---|---|
| Name: | pentachloroethane | |
| Description: | ||
| Labels: | Training | |
| CAS: | 76-01-7 | |
| InChi Code: | InChI=1S/C2HCl5/c3-1(4)2(5,6)7/h1H |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| 1.4 |
experimental value |
| 1.73 |
Eq1: Full Model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7021104 | US EPA CompTox Dashboard |