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Deprotonation of Benzoxazolium Salt: Trapping of a Radical-Cation Intermediate.

Svetlana V KlementyevaPavel A AbramovNikolay V SomovYulia B DudkinaYulia H BudnikovaAndrey I Poddel'sky
Published in: Organic letters (2019)
The deprotonation of N-2,6-diisopropylphenyl-substituted benzoxazolium tetrafluoroborate 1 with NaH results in the formation of electron-rich diaminodioxaethylene 2. The radical cation salt 2·+·BF4- is found to be an intermediate product in the redox reaction leading from 1 to 2.
Keyphrases
  • ionic liquid
  • electron transfer
  • molecular docking
  • molecular dynamics simulations