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:	114
	Name:	1,3,5-Cycloheptatriene
	Description:
	Labels:	alkenes
	CAS:	544-25-2
	InChi Code:	InChI=1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2

Properties

pkNO3: Degradation by NO3 radicals as -logkNO3 [log(s molecule/cm3)] i

Value	Source or prediction
11.92	experimental value
10.77	Eq1: Full model (Training set)

Links to External Resources

Link	Resource description
DTXSID5073909	US EPA CompTox Dashboard