Controlled synthesis of electron deficient nitro-1H-benzotriazoles

C.J. McHugh, D.R. Tackley, D. Graham

Research output: Contribution to journalArticle

8 Citations (Scopus)

Abstract

Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.
Original languageEnglish
Pages (from-to)1461-1470
Number of pages9
JournalHeterocycles
Volume57
Issue number8
Publication statusPublished - 1 Aug 2002

Keywords

  • preparation
  • nitration
  • 1H-benzotriazole
  • isomerism
  • DFT

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