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:	t331
	Name:	2-nitro-p-cresol
	Description:
	Labels:	Training
	CAS:	119-33-5
	InChi Code:	InChI=1S/C7H7NO3/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
0.95	experimental value
0.7483	Tab2: Multilinear model for diverse chemicals (Training set)
0.7483	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (Training set)

Links to External Resources

Link	Resource description
DTXSID0026961	US EPA CompTox Dashboard