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: | 123 | |
|---|---|---|
| Name: | cyclohexanol | |
| Description: | ||
| Labels: | Training | |
| CAS: | 108-93-0 | |
| InChi Code: | InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2 |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| -1.77 |
experimental value |
| -2.05 |
Eq1: Full Model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID4021894 | US EPA CompTox Dashboard |