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:	t191
	Name:	o-chlorotoluene
	Description:
	Labels:	Training
	CAS:	95-49-8
	InChi Code:	InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
1.82	experimental value
1.8226	Tab2: Multilinear model for diverse chemicals (Training set)
1.8226	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (Training set)

Links to External Resources

Link	Resource description
DTXSID8023977	US EPA CompTox Dashboard