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:	27
	Name:	2-Butanol
	Description:
	Labels:	alcohols
	CAS:	78-92-2
	InChi Code:	InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3

Properties

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

Value	Source or prediction
14.68	experimental value
15.25	Eq1: Full model (Training set)

Links to External Resources

Link	Resource description
DTXSID9021762	US EPA CompTox Dashboard