Arylruthenium(III) Porphyrin-Catalyzed C-H Oxidation and Epoxidation at Room Temperature and [RuV(Por)(O)(Ph)] Intermediate by Spectroscopic Analysis and Density Functional Theory Calculations.

The development of highly active and selective metal catalysts for efficient oxidation of hydrocarbons and identification of the reactive intermediates in the oxidation catalysis are long-standing challenges. In the rapid hydrocarbon oxidation catalyzed by ruthenium(IV) and -(III) porphyrins, the pu...

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Publicado en:Journal of the American Chemical Society Vol. 140; no. 22; pp. 7032 - 7043
Autores principales: Shing, Ka-Pan, Cao, Bei, Liu, Yungen, Li, Ming-De, Phillips, David Lee, Chang, Xiao-Yong, Che, Chi-Ming, Lee, Hung Kay
Formato: Artículo
Publicado: American Chemical Society 6/6/2018
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Acceso en línea:Ver este registro en EBSCOhost
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      dt: 6/6/2018
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      pub: American Chemical Society
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        10.1021/jacs.8b04470
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        atl: Arylruthenium(III) Porphyrin-Catalyzed C-H Oxidation and Epoxidation at Room Temperature and [RuV(Por)(O)(Ph)] Intermediate by Spectroscopic Analysis and Density Functional Theory Calculations.
      aug:
        au:
          Shing, Ka-Pan
          Cao, Bei
          Liu, Yungen
          Li, Ming-De
          Phillips, David Lee
          Chang, Xiao-Yong
          Che, Chi-Ming
          Lee, Hung Kay
        affil:
          Department of Chemistry and State Key Laboratory of Synthetic Chemistry, The University of Hong Kong, Pokfulam Road, Hong Kong, China[sup
          HKU Shenzhen Institute of Research and Innovation, Shenzhen 518053, China
          Department of Cell Biology, New York University Medical Center, New York, New York, U.S.A
      su:
        Oxidation
        Epoxidation
        Spectroscopic imaging
        Density functional theory
        Metal catalysts
      sug:
        subj:
          Oxidation
          Epoxidation
          Spectroscopic imaging
          Density functional theory
          Metal catalysts
      ab: The development of highly active and selective metal catalysts for efficient oxidation of hydrocarbons and identification of the reactive intermediates in the oxidation catalysis are long-standing challenges. In the rapid hydrocarbon oxidation catalyzed by ruthenium(IV) and -(III) porphyrins, the putative Ru(V)-oxo intermediates remain elusive. Herein we report that arylruthenium(III) porphyrins are highly active catalysts for hydrocarbon oxidation. Using catalyst [Ru(TDCPP)(Ph)(OEt)] (HTDCPP = 5,10,15,20-tetrakis(2,6-dichlorophenyl)porphyrin), the oxidation of C-H bonds of various hydrocarbons with oxidant m-CPBA at room temperature gave alcohols/ketones in up to 99% yield within 1 h; use of [BuN]IO as a mild alternative oxidant avoided formation of lactone from cyclic ketone in C-H oxidation, and the catalytic epoxidation with up to 99% yield and high selectivity (no aldehydes as side product) was accomplished within 5 min. UV-vis, electrospray ionization-mass spectrometry, resonance Raman, electron paramagnetic resonance, and kinetic measurements and density functional theory calculations lend evidence for the formation of Ru(V)-oxo intermediate [Ru(TDCPP)(O)(Ph)].
      pubtype: Academic Journal
      doctype: Article
      src: R
    language: English
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          year: 2018
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