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:	p320
	Name:	1,2-dichloro-4-nitrobenzene
	Description:
	Labels:	Validation, 1
	CAS:	99-54-7
	InChi Code:	InChI=1S/C6H3Cl2NO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
1.71	experimental value
2.2275	Tab2: Multilinear model for diverse chemicals (External validation set 1)
2.2275	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 1)

Links to External Resources

Link	Resource description
DTXSID8024999	US EPA CompTox Dashboard