Papa, E.; Gramatica, P. Externally validated QSPR modelling of VOC tropospheric oxidation by NO3 radicals. SAR QSAR Environ. Res. 2008, 19, 655–668.
Compound
| ID: | 40 | |
|---|---|---|
| Name: | alpha-Phellandrene | |
| Description: | ||
| Labels: | alkenes | |
| CAS: | 99-83-2 | |
| InChi Code: | InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3 |
Properties
pkNO3: Degradation by NO3 radicals as -logkNO3 [log(s molecule/cm3)] i
| Value | Source or prediction |
|---|---|
| 10.14 |
experimental value |
| 10.48 |
Eq1: Full model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID4047593 | US EPA CompTox Dashboard |