1-Non-1-ynylbenzimidazole | 1346672-50-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 1-Non-1-ynylbenzimidazole
• 英文别名: 1-non-1-ynylbenzimidazole
• CAS: 1346672-50-1
• 化学式: C₁₆H₂₀N₂
• 分子量: 240.348
• InChiKey: MSVLYBFJKMCWKY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  17.8
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  苯并咪唑 、 1,1-dibromo-1-nonene 在 溴代(1,10-菲咯啉)(三苯基膦)铜(I) 、 caesium carbonate 作用下， 以 二甲基亚砜 为溶剂， 反应 3.0h， 以75%的产率得到1-Non-1-ynylbenzimidazole
  参考文献：
  名称：

  Copper-catalyzed coupling of imidazoles and pyrazoles with 1,1-dibromo-1-alkenes: a distinct approach for direct N-alkynylation of heteroarenes

  摘要：

  The direct N-alkynylation of heteroarenes, imidazoles, and pyrazoles with 1,1-dibromo-1-alkene has been carried out for the first time using [Cu(Phen)PPh3Br] (as a catalyst) and Cs2CO3 in DMSO at 80 degrees C. The products are formed in good to high yields (66-85%) within 3 h. No side products could be detected. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.09.117

文献信息

• Copper-catalyzed coupling of imidazoles and pyrazoles with 1,1-dibromo-1-alkenes: a distinct approach for direct N-alkynylation of heteroarenes
  作者：Biswanath Das、N. Salvanna、Gandolla Chinna Reddy、Penagaluri Balasubramanyam

  DOI：10.1016/j.tetlet.2011.09.117

  日期：2011.11

  The direct N-alkynylation of heteroarenes, imidazoles, and pyrazoles with 1,1-dibromo-1-alkene has been carried out for the first time using [Cu(Phen)PPh3Br] (as a catalyst) and Cs2CO3 in DMSO at 80 degrees C. The products are formed in good to high yields (66-85%) within 3 h. No side products could be detected. (C) 2011 Elsevier Ltd. All rights reserved.