Gramatica, P.; Pilutti, P.; Papa, E. Predicting the NO3 radical tropospheric degradability of organic pollutants by theoretical molecular descriptors. Atmos. Environ. 2003, 37, 3115–3124.

Compound

	ID:	96
	Name:	1-Ethyl-4-methylbenzene
	Description:
	Labels:
	CAS:	622-96-8
	InChi Code:	InChI=1S/C9H12/c1-3-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3

Properties

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

Value	Source or prediction
15.21	experimental value
15.11	Model: Model for organic pollutants (Training set)

Links to External Resources

Link	Resource description
DTXSID9029194	US EPA CompTox Dashboard