Article ID Journal Published Year Pages File Type
5221437 Tetrahedron 2011 5 Pages PDF
Abstract

We have successfully obtained the first unambiguous spectroscopic proof of the structure of heptafluoropropan-2-ol by 13C NMR, which has been assumed from early 70s but without unequivocal evidence. Equilibrating relationship between fluorinated ketones and the corresponding hydrates as well as α-fluoroalcohols in anhydrous HF was at least qualitatively supported by our ab initio computation, and moreover, anhydrous HF as a convenient solvent was found to offer an effective new route for production of 1,1,1,3,3,3-hexafluoropropan-2-ol in industrial scales.

Graphical abstractFigure optionsDownload full-size imageDownload as PowerPoint slide

Related Topics
Physical Sciences and Engineering Chemistry Organic Chemistry