10967/121 - QDB Compounds

QsarDB Repository

Gajewicz, A.; Haranczyk, M.; Puzyn, T. Predicting logarithmic values of the subcooled liquid vapor pressure of halogenated persistent organic pollutants with QSPR: How different are chlorinated and brominated congeners?. Atmos. Environ. 2010, 44, 11, 1428–1436.

Compound

ID:PCDF-013
Name:2,4-Dichlorodibenzofuran
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H6Cl2O/c13-7-5-9-8-3-1-2-4-11(8)15-12(9)10(14)6-7/h1-6H

Properties

logPL: Liquid vapor pressure [Pa]

ValueSource or prediction
-1.56794413290068

Eq.2: GA-PLS model (Test set)