10967/146 - QDB Compounds

QsarDB Repository

Papa, E.; Kovarich, S.; Gramatica, P. Development, Validation and Inspection of the Applicability Domain of QSPR Models for Physicochemical Properties of Polybrominated Diphenyl Ethers. QSAR Comb. Sci. 2009, 28, 790–796.

12 compounds | Property LogSw: Water solubility as logSw [mol/L] i

IDNameLogSwDetails
151-bromo-4-(4-bromophenoxy)benzene i-6.4View
282,4-dibromo-1-(4-bromophenoxy)benzene i-6.76View
472,4-dibromo-1-(2,4-dibromophenoxy)benzene i-7.51View
662,4-dibromo-1-(3,4-dibromophenoxy)benzene i-7.43View
771,2-dibromo-4-(3,4-dibromophenoxy)benzene i-7.91View
851,2,3-tribromo-4-(2,4-dibromophenoxy)benzene i-7.97View
991,2,4-tribromo-5-(2,4-dibromophenoxy)benzene i-7.78View
1001,3,5-tribromo-2-(2,4-dibromophenoxy)benzene i-7.15View
1531,2,4-tribromo-5-(2,4,5-tribromophenoxy)benzene i-8.87View
1541,2,4-tribromo-5-(2,4,6-tribromophenoxy)benzene i-8.87View
1831,2,3,5-tetrabromo-4-(2,4,5-tribromophenoxy)benzene i-8.68View
220hexabromobenzene i-8.26View

Bibliography

  1. Tittlemier, S. A.; Halldorson, T.; Stern, G. A.; Tomy, G. T. Vapor pressures, aqueous solubilities, and Henry’s law constants of some brominated flame retardants. Environmental Toxicology and Chemistry 2002, 21, 1804–1810. http://dx.doi.org/10.1002/etc.5620210907