Gramatica, P.; Pilutti, P.; Papa, E. Predicting the NO3 radical tropospheric degradability of organic pollutants by theoretical molecular descriptors. Atmos. Environ. 2003, 37, 3115–3124.
Compound
| ID: | 99 | |
|---|---|---|
| Name: | 1,4-Cyclohexadiene | |
| Description: | ||
| Labels: | ||
| CAS: | 628-41-1 | |
| InChi Code: | InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2 |
Properties
pkNO3: Degradation by NO3 radicals as -logkNO3 [-log(cm3/(s.{molecule}))]
| Value | Source or prediction |
|---|---|
| 12.27 |
experimental value |
| 11.56 |
Model: Model for organic pollutants (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0060854 | US EPA CompTox Dashboard |