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:	t198
	Name:	1,3,5-trichlorobenzene
	Description:
	Labels:	Training
	CAS:	108-70-3
	InChi Code:	InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
2.97	experimental value
2.4612	Tab2: Multilinear model for diverse chemicals (Training set)
2.4612	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (Training set)

Links to External Resources

Link	Resource description
DTXSID8026195	US EPA CompTox Dashboard