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Selective oxidative dehydrogenation of propane to propene using boron nitride catalysts

机译:使用氮化硼催化剂将丙烷选择性氧化脱氢为丙烯

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摘要

The exothermic oxidative dehydrogenation of propane reaction to generate propene has the potential to be a game-changing technology in the chemical industry. However, even after decades of research, selectivity to propene remains too low to be commercially attractive because of overoxidation of propene to thermodynamically favored CO2. Here, we report that hexagonal boron nitride and boron nitride nanotubes exhibit unique and hitherto unanticipated catalytic properties, resulting in great selectivity to olefins. As an example, at 14% propane conversion, we obtain selectivity of 79% propene and 12% ethene, another desired alkene. Based on catalytic experiments, spectroscopic insights, and ab initio modeling, we put forward a mechanistic hypothesis in which oxygen-terminated armchair boron nitride edges are proposed to be the catalytic active sites.
机译:丙烷反应放热氧化脱氢以生成丙烯,可能会改变化学工业中的游戏规则。然而,即使经过数十年的研究,由于丙烯被热力学上有利的CO2过度氧化,因此对丙烯的选择性仍然太低而在商业上没有吸引力。在这里,我们报道六角形的氮化硼和氮化硼纳米管表现出独特的和迄今未曾预料到的催化性能,从而导致对烯烃的极大选择性。例如,在丙烷转化率为14%时,我们获得了79%的丙烯和12%的乙烯(另一种所需的烯烃)的选择性。基于催化实验,光谱学见识和从头算模型,我们提出了一种机械假设,其中氧封端的扶手椅氮化硼边缘被提议为催化活性位点。

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  • 来源
    《Science》 |2016年第6319期|1570-1573|共4页
  • 作者单位

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem & Biol Engn, 1415 Engn Dr, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem & Biol Engn, 1415 Engn Dr, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA;

    Univ Wisconsin, Dept Chem, 1101 Univ Ave, Madison, WI 53706 USA|Univ Wisconsin, Dept Chem & Biol Engn, 1415 Engn Dr, Madison, WI 53706 USA;

  • 收录信息 美国《科学引文索引》(SCI);美国《工程索引》(EI);美国《生物学医学文摘》(MEDLINE);美国《化学文摘》(CA);
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  • 正文语种 eng
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