Wang, Y.-n.; Chen, J.; Li, X.; Zhang, S.; Qiao, X. Estimation of Aqueous-Phase Reaction Rate Constants of Hydroxyl Radical with Phenols, Alkanes and Alcohols. QSAR Comb. Sci. 2009, 28, 1309–1316.

Compound

	ID:	22
	Name:	n-Butane
	Description:
	Labels:
	CAS:	106-97-8
	InChi Code:	InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3

Properties

logkOH: aqueous-phase hydroxyl radical reaction rate constant as logkOH [L/mol.s]

Value	Source or prediction
9.66	experimental value
9.57	Eq.6: Model for phenols, alkenes and alcohols (Training set)

Links to External Resources

Link	Resource description
DTXSID7024665	US EPA CompTox Dashboard