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-042
Name:2,3,8-trichlorodibenzofuran
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H5Cl3O/c13-6-1-2-11-7(3-6)8-4-9(14)10(15)5-12(8)16-11/h1-5H

Properties

logPL: Liquid vapor pressure [Pa]

ValueSource or prediction
-2.50559764595614

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

Links to External Resources