Please use this identifier to cite or link to this item: https://scidar.kg.ac.rs/handle/123456789/10305
Title: Stabilization of long-chain intermediates in solution. octyl radicals and cations
Authors: Teodorovic A.
Badjuk D.
Stevanović, Nenad
Pavlovic, Radisa
Issue Date: 2013
Abstract: The rearrangements of 1-octyl, 1-decyl and 1-tridecyl intermediates obtained from thermal lead(IV) acetate (LTA) decarboxylation of nonanoic, undecanoic and tetradecanoic acid were investigated experimentally through analysis and distribution of the products. The relationships between 1,5-, 1,6- and possibly existing 1,7-homolytic hydrogen transfer in 1-octyl-radical, as well as successive 1,2-hydride shift in corresponding cation have been computed via Monte-Carlo method. Taking into account that ratios of 1,5-/1,6-homolytic rearrangements in 1-octyl- and 1-tridecyl radical are approximately the same, the simulation shows very low involvement of 1,7-hydrogen rearrangement (1,5-/1,6-/1,7-hydrogen rearrangement = 85:31:1) in 1-octyl radical. © 2013 Elsevier B.V. All rights reserved.
URI: https://scidar.kg.ac.rs/handle/123456789/10305
Type: article
DOI: 10.1016/j.molstruc.2013.02.020
ISSN: 0022-2860
SCOPUS: 2-s2.0-84875074046
Appears in Collections:Faculty of Science, Kragujevac

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