Piir, G.; Sild, S.; Roncaglioni, A.; Benfenati, E.; Maran, U. QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects. SAR QSAR Environ. Res. 2010, 21, 7-8, 711-729.

Compound

	ID:	e609
	Name:	1,2,5-trichloro-3-methoxybenzene
	Description:
	Labels:	Validation, 2
	CAS:	54135-81-8
	InChi Code:	InChI=1S/C7H5Cl3O/c8-5-1-4(3-11)7(10)6(9)2-5/h1-2,11H,3H2

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
3.09	experimental value
1.5315	Tab2: Multilinear model for diverse chemicals (External validation set 2)
1.5315	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2)

Links to External Resources

Link	Resource description
DTXSID70202478	US EPA CompTox Dashboard