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Brominated isoindolines: Precursors to functionalised nitroxides

Micallef, Aaron S. and Bott, Raymond C. and Bottle, Steven E. and Smith, Graham and White, Jonathon M. and Matsuda, Kenji and Iwamura, Hiizu (1999) Brominated isoindolines: Precursors to functionalised nitroxides. Journal of the Chemical Society, Perkin 2(001):pp. 65-72.

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Abstract

A new, convenient method for the preparation of functionalised precursors to stable tetraalkylisoindoline nitroxides (aminoxyls) is presented. Simple treatment of 2-benzyl-1,1,3,3-tetramethylisoindoline 2 with Br2 in CCl4 gives rapid oxidative debenzylation, generating benzaldehyde and an unusual bromamine, 2-bromo-1,1,3,3-tetramethylisoindoline 4, in high yield. Treatment of the bromamine 4 with FeSO4 / H2SO4 results in bromination of the aromatic ring in varying yield, while rapid treatment with peroxide / tungstate causes debromination, generating 1,1,3,3-tetramethylisoindoline 3. Bromination of the isoindoline aromatic ring is more readily afforded by treatment of 2-benzyl-1,1,3,3-tetramethylisoindoline 2 with Br2 and AlCl3 in CCl4, producing 2,5-dibromo-1,1,3,3-tetramethylisoindoline 7 and/or 2,5,6-tribromo-1,1,3,3-tetramethylisoindoline 6 in varying yields depending upon the exact reaction conditions. Rapid treatment with peroxide / tungstate generates the corresponding bromine substituted isoindolines, 5-bromo-1,1,3,3-tetramethylisoindoline 5 and 5,6-dibromo-1,1,3,3-tetramethylisoindoline 8. Prolonged peroxide / tungstate treatment oxidises the substituted bromamines to the corresponding nitroxides, 5-bromo-1,1,3,3-tetramethylisoindolin-2-yloxyl 9 and 5,6-dibromo-1,1,3,3-tetramethylisoindolin-2-yloxyl 10. SQUID magnetic susceptibility measurements of crystalline 10 reveal strong antiferromagnetic interradical spin coupling. The crystal structures of 10, 2-bromo-1,1,3,3-tetramethylisoindoline 4 and the hydrobromide dihydrate salt of 1,1,3,3-tetramethylisoindoline 3 (3a) have also been determined, with 10 displaying an interesting molecular packing arrangement

Item Type:Journal Article
Status:Published
Subjects:250000 Chemical Sciences
ID Code:1670
Deposited By:Callan, Paula
Deposited On:18 October 2005
Alternative Locations:http://www.rsc.org/
Copyright Owner:Copyright 1999 Royal Society of Chemistry
Copyright Statement:Reproduced by permission of The Royal Society of Chemistry, no further distribution permitted.
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