In an article, author is Vila, Antonio, once mentioned the application of 4330-21-6, Name is Hoffer’s chlorosugar, molecular formula is C21H21ClO5, molecular weight is 388.8415, MDL number is MFCD01630916, category is dioxoles. Now introduce a scientific discovery about this category, Name: Hoffer’s chlorosugar.
On the non-planarity of 1,3-dioxole and 1,3-dioxolane
The conformational preferences of 1,3-dioxole and 1,3-dioxolane are explained on the basis of the QTAIM electron density analysis of B3LYP/6-311++ G(2d, 2p) electron distributions, supporting the interpretation of the anomeric effect previously proposed by Vila and Mosquera [14]. Thus, distances from methylenic hydrogens to oxygen lone pairs and H-C-O-lp dihedral angles sufficiently explain the atomic population and energy variations, thereby explaining the ring puckering preference. (C) 2010 Elsevier B.V. All rights reserved.
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Reference:
1,3-Benzodioxole – Wikipedia,
,Dioxole | C3H4O2 – PubChem