Wen, Y.; Su, L. M.; Qin, W. C.; Fu, L.; He, J.; Zhao, Y. H. Linear and non-linear relationships between soil sorption and hydrophobicity: Model, validation and influencing factors. Chemosphere 2012, 86, 634–640.

Compound

	ID:	103
	Name:	Ethyl 3,5-dinitrobenzoate
	Description:
	Labels:	training, Nitrobenzenes
	CAS:	618-71-3
	InChi Code:	InChI=1S/C9H8N2O6/c1-2-17-9(12)6-3-7(10(13)14)5-8(4-6)11(15)16/h3-5H,2H2,1H3

Properties

logKoc: Logarithm of soil sorption coefficient i

Value	Source or prediction
2.74	experimental value
1.63	Eq1: Linear correlation with logP (Training set)
1.72	Eq2: Non-linear regression model (Training set)
1.72	Eq3: Non-linear regression model with correction factors (Training set)

Links to External Resources

Link	Resource description
DTXSID20210801	US EPA CompTox Dashboard