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:	245
	Name:	2-chlorodibenzo-p-dioxin
	Description:
	Labels:	Training
	CAS:	39227-54-8
	InChi Code:	InChI=1S/C12H7ClO2/c13-8-5-6-11-12(7-8)15-10-4-2-1-3-9(10)14-11/h1-7H

Properties

PBT_Index: PBT Index i

Value	Source or prediction
1.85	experimental value
1.63	Eq1: Full Model (Training set)

Links to External Resources

Link	Resource description
DTXSID90192488	US EPA CompTox Dashboard