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:	70
	Name:	n-Hexane
	Description:
	Labels:	alkanes
	CAS:	110-54-3
	InChi Code:	InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3

Properties

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

Value	Source or prediction
15.96	experimental value
15.3	Eq1: Full model (Training set)

Links to External Resources

Link	Resource description
DTXSID0021917	US EPA CompTox Dashboard