Theoretical and Experimental Studies on the Baeyer−Villiger Oxidation of Ketones and the Effect of α-Halo Substituents

The Baeyer−Villiger reactions of acetone and 3-pentanone, including their fluorinated and chlorinated derivatives, with performic acid have been studied by ab initio and DFT calculations. Results are compared with experimental findings for the Baeyer−Villiger oxidation of aliphatic fluoro and chloro...

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Veröffentlicht in:Journal of organic chemistry 2006-02, Vol.71 (3), p.861-872
Hauptverfasser: Grein, Friedrich, Chen, Austin C, Edwards, David, Crudden, Cathleen M
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Sprache:eng
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