Linear Free Energy Relationship Correlation of the Distribution of Solutes between Water and Sodium Dodecyl Sulfate (SDS) Micelles and between Gas and SDS Micelles

Data have been assembled from the published literature on the water-to-micellar sodium dodecyl sulfate (SDS) partition coefficient data for more than 200 compounds and on the gas-to-micellar SDS partition coefficient data for more than 140 compounds. It is shown that an Abraham solvation equation wi...

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Bibliographic Details
Published in:Journal of chemical information and modeling 2007-09, Vol.47 (5), p.1808-1817
Main Authors: Sprunger, Laura, Acree, William E, Abraham, Michael H
Format: Article
Language:English
Subjects:
Algorithms
Atoms & subatomic particles
Chemical compounds
Chemical Phenomena
Chemistry, Physical
Chromatography, Micellar Electrokinetic Capillary
Gases
Micelles
Models, Chemical
Regression Analysis
Sodium
Sodium Dodecyl Sulfate - chemistry
Solute movement
Solutions
Solvents
Water
Water - chemistry
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Summary:Data have been assembled from the published literature on the water-to-micellar sodium dodecyl sulfate (SDS) partition coefficient data for more than 200 compounds and on the gas-to-micellar SDS partition coefficient data for more than 140 compounds. It is shown that an Abraham solvation equation with only five descriptors can be used to correlate the observed partition coefficient data to within a standard deviation of 0.22 log units. Micellar electrokinetic chromatographic (MEKC) retention factor data measured on a micellar SDS pseudostationary phase was also gathered from the literature. The water-to-micellar SDS partition coefficient and MEKC retention factor data were combined into a single database and correlated with the Abraham model. The derived correlation described the 486 experimental values to within a standard deviation of 0.15 log units. The micellar SDS system has been compared to various liquid phases in terms of solubility of gases and vapors and has been shown to be a very selective systemî—¸more so than room-temperature ionic liquids.
ISSN:1549-9596
1549-960X
DOI:10.1021/ci700174q