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:PBB-016
Name:2,3,2'-Tribromobiphenyl
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H7Br3/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7H

Properties

logPL: Liquid vapor pressure [Pa]

ValueSource or prediction
-1.73048216118568

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