Papa, E.; Gramatica, P. QSPR as a support for the EU REACH regulation and rational design of environmentally safer chemicals: PBT identification from molecular structure. Green Chem. 2010, 12, 836-843.

Compound

	ID:	92
	Name:	methoxybenzene
	Description:
	Labels:	Training
	CAS:	100-66-3
	InChi Code:	InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3

Properties

PBT_Index: PBT Index i

Value	Source or prediction
-0.23	experimental value
-0.26	Eq1: Full Model (Training set)

Links to External Resources

Link	Resource description
DTXSID4041608	US EPA CompTox Dashboard