3,9-dimethyl-3-(2,3,4,5,6-pentafluorophenoxy)-2,4-dihydro-1H-carbazole | 1158986-80-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 3,9-dimethyl-3-(2,3,4,5,6-pentafluorophenoxy)-2,4-dihydro-1H-carbazole
• CAS: 1158986-80-1
• 化学式: C₂₀H₁₆F₅NO
• 分子量: 381.345
• InChiKey: ISTJILOYBNAPOV-UHFFFAOYSA-N

物化性质

• 沸点：
  451.4±45.0 °C(predicted)
• 密度：
  1.38±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  27
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  14.2
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  五氟苯酚 、 1-methyl-2-(3-methylbut-3-enyl)-1H-indole 在 palladium diacetate 、 对苯醌 作用下， 以 甲苯 为溶剂， 反应 8.0h， 以74%的产率得到3,9-dimethyl-3-(2,3,4,5,6-pentafluorophenoxy)-2,4-dihydro-1H-carbazole
  参考文献：
  名称：

  Novel Palladium-Catalyzed Acyloxylation/Cyclization of 2-(3′-Alkenyl)indoles

  摘要：

  A new and mild palladium(II)-catalyzed reaction for the intramolecular acyloxylation/cyclization of 2-(3'-alkenyl)indoles was developed. The newly formed cycles involve oxygen-containing functionalized groups, which might be transferred further to provide other indole derivatives.

  DOI：

  10.1021/ol9007348

文献信息

• Novel Palladium-Catalyzed Acyloxylation/Cyclization of 2-(3′-Alkenyl)indoles
  作者：Xiuling Han、Xiyan Lu

  DOI：10.1021/ol9007348

  日期：2009.6.4

  A new and mild palladium(II)-catalyzed reaction for the intramolecular acyloxylation/cyclization of 2-(3'-alkenyl)indoles was developed. The newly formed cycles involve oxygen-containing functionalized groups, which might be transferred further to provide other indole derivatives.