1,2-diphenyl-5-(3-(trifluoromethyl)phenyl)-1H-pyrrole | 1430102-68-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 1,2-diphenyl-5-(3-(trifluoromethyl)phenyl)-1H-pyrrole
• 英文别名: 1,2-Diphenyl-5-[3-(trifluoromethyl)phenyl]pyrrole；1,2-diphenyl-5-[3-(trifluoromethyl)phenyl]pyrrole
• CAS: 1430102-68-3
• 化学式: C₂₃H₁₆F₃N
• 分子量: 363.382
• InChiKey: UFUYGUBEPNDNFX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  27
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  4.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-(phenylbuta-1,3-diynyl)-3-(trifluoromethyl)benzene 、 苯胺 在 copper(l) chloride 作用下， 以 neat (no solvent) 为溶剂， 反应 24.0h， 以50%的产率得到1,2-diphenyl-5-(3-(trifluoromethyl)phenyl)-1H-pyrrole
  参考文献：
  名称：

  Copper-Catalyzed Decarboxylative Coupling of Alkynyl Carboxylates with 1,1-Dibromo-1-alkenes

  摘要：

  A copper-catalyzed decarboxylative coupling reaction of potassium alkynyl carboxylates with 1,1-dibromo-1-alkenes was developed for the synthesis of unsymmetrical 1,3-diyne and 1,3,5-triyne derivatives. Diverse aryl, alkenyl, alkynyl, and alkyl substituted 1,1-dibromo-1-alkenes can react smoothly with aryl and alkyl substituted propiolates to produce unsymmetrical 1,3-diynes and 1,3,5-triynes with high selectivity and good functional group compatibility.

  DOI：

  10.1021/jo400616r

文献信息

• Copper-Catalyzed Decarboxylative Coupling of Alkynyl Carboxylates with 1,1-Dibromo-1-alkenes
  作者：Zheng Huang、Rui Shang、Zi-Rong Zhang、Xiao-Dan Tan、Xiao Xiao、Yao Fu

  DOI：10.1021/jo400616r

  日期：2013.5.3

  A copper-catalyzed decarboxylative coupling reaction of potassium alkynyl carboxylates with 1,1-dibromo-1-alkenes was developed for the synthesis of unsymmetrical 1,3-diyne and 1,3,5-triyne derivatives. Diverse aryl, alkenyl, alkynyl, and alkyl substituted 1,1-dibromo-1-alkenes can react smoothly with aryl and alkyl substituted propiolates to produce unsymmetrical 1,3-diynes and 1,3,5-triynes with high selectivity and good functional group compatibility.