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:	79
	Name:	Decanal
	Description:
	Labels:	aldehydes
	CAS:	112-31-2
	InChi Code:	InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3

Properties

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

Value	Source or prediction
13.66	experimental value
14.45	Eq1: Full model (Training set)

Links to External Resources

Link	Resource description
DTXSID4021553	US EPA CompTox Dashboard