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: | 85 | |
|---|---|---|
| Name: | 1,2,3-Trimethylbenzene | |
| Description: | ||
| Labels: | ||
| CAS: | 526-73-8 | |
| InChi Code: | InChI=1S/C9H12/c1-7-5-4-6-8(2)9(7)3/h4-6H,1-3H3 |
Properties
pkNO3: Degradation by NO3 radicals as -logkNO3 [-log(cm3/(s.{molecule}))]
| Value | Source or prediction |
|---|---|
| 14.73 |
experimental value |
| 15.12 |
Model: Model for organic pollutants (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8047769 | US EPA CompTox Dashboard |