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    Review date: July 24, 2003
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    Effect of Fluorine Substitution, Pressure and Temperature on the Tautomeric Equilibria of Acetylacetonate b-diketones


    SL Wallen, CR Yonker, CL Phelps, and CM Wai. J. Chem. Soc., Faraday Trans., 93(14):2391-2394 (1997).

    Abstract: The equilibrium between the keto and enol tautomers of acetylacetone, trifluoroacetylacetone, and hexafluoroacetylacetone in the neat liquid state and dissolved in supercritical fluid carbon dioxide have been studied, as a function of pressure and temperature, by 1H NMR. This allows determination of the thermodynamic parameters, H and S, for the keto-enol equilibrium. The observed trends are well correlated with extraction results for this class of compounds.


    For information about supercritical fluid capabilities at PNNL,
    please contact Clement Yonker, at (509) 372-4748, clem.yonker@pnl.gov.