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:	277
	Name:	3-Methylcholanthrene
	Description:
	Labels:	training, PAHs
	CAS:	56-49-5
	InChi Code:	InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3

Properties

logKoc: Logarithm of soil sorption coefficient i

Value	Source or prediction
6.1	experimental value
5.42	Eq1: Linear correlation with logP (Training set)
5.50	Eq2: Non-linear regression model (Training set)
5.94	Eq3: Non-linear regression model with correction factors (Training set)

Links to External Resources

Link	Resource description
DTXSID0020862	US EPA CompTox Dashboard