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:	t2
	Name:	n-nonane
	Description:
	Labels:	Training
	CAS:	111-84-2
	InChi Code:	InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
3.15	experimental value
3.3162	Tab2: Multilinear model for diverse chemicals (Training set)
3.3162	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (Training set)

Links to External Resources

Link	Resource description
DTXSID9025796	US EPA CompTox Dashboard