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: | 159 | |
|---|---|---|
| Name: | 1,2,4-trichlorobenzene | |
| Description: | ||
| Labels: | Training | |
| CAS: | 120-82-1 | |
| InChi Code: | InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| 2.1 |
experimental value |
| 1.69 |
Eq1: Full Model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0021965 | US EPA CompTox Dashboard |