10967/180 - QDB Compounds

QsarDB Repository

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:229
Name:2,8-dichlorodibenzofuran
Description:
Labels:Training
CAS:5409-83-6
InChi Code:InChI=1S/C12H6Cl2O/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6H

Properties

PBT_Index: PBT Index i

ValueSource or prediction
2.52

experimental value

2.93

Eq1: Full Model (Training set)