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Palladium-catalyzed regioselective synthesis of B(4,5)- or B(4)-substituted o-carboranes containing α,β-unsaturated carbonyls.

Chuyi ZhangQian WangSong TianJianwei ZhangJiaoyi LiLing ZhouJian Lu
Published in: Organic & biomolecular chemistry (2021)
With the help of a carboxylic acid directing group, Pd-catalyzed regioselective synthesis of B(4,5)- or B(4)-substituted o-carboranes containing α,β-unsaturated carbonyls has been reported. The -COOH, removed during the course of the reaction, is responsible for controlling the regioselectivity. The desired products could be obtained in moderate to good yields.
Keyphrases
  • molecular docking
  • high intensity
  • room temperature
  • molecular dynamics simulations