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:	71
	Name:	benzo(b)thiophene
	Description:
	Labels:	Training
	CAS:	95-15-8
	InChi Code:	InChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H

Properties

PBT_Index: PBT Index i

Value	Source or prediction
1.04	experimental value
0.7	Eq1: Full Model (Training set)

Links to External Resources

Link	Resource description
DTXSID2052736	US EPA CompTox Dashboard