3-formylthiophene-2-carboxylic acid cyclohexylamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 噻吩类
• 英文名称: 3-formylthiophene-2-carboxylic acid cyclohexylamide
• 英文别名: N-cyclohexyl-3-formylthiophene-2-carboxamide
• 化学式: C₁₂H₁₅NO₂S
• 分子量: 237.323
• InChiKey: SDRLWBTXWLNWDF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  74.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  生成 3-formylthiophene-2-carboxylic acid cyclohexylamide
  参考文献：
  名称：

  Hydroarylation of acetylenes, acrylates, and isocyanates with heteroaromatic compounds under rhenium catalysis

  摘要：

  With the aid of a directing group, an imine moiety, heteroaromatic compounds add to acetylenes in the presence of a catalytic amount of [ReBr(CO)(3)(THF)](2) at the adjacent position of the directing group regioselectively to give hydroarylation of the acetylenes in good to excellent yields. Similarly, heteroaromatic compounds react with acrylates and isocyanates to give the corresponding hydroarylation products under rhenium catalysis. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.01.145

文献信息

• Rhenium-catalyzed Amidation of Heteroaromatic Compounds via C–H Bond Activation
  作者：Yoichiro Kuninobu、Yukimi Tokunaga、Kazuhiko Takai

  DOI：10.1246/cl.2007.872

  日期：2007.7.5

  Regioselective insertion of isocyanates into a C–H bond of heteroaromatic compounds took place using a rhenium catalyst, [ReBr(CO)3(thf)]2.

  使用铼催化剂 [ReBr(CO)3(thf)]2，将异氰酸酯区域选择性地插入杂芳香族化合物的 C-H 键。
• Hydroarylation of acetylenes, acrylates, and isocyanates with heteroaromatic compounds under rhenium catalysis
  作者：Yoichiro Kuninobu、Kou Kikuchi、Yukimi Tokunaga、Yuta Nishina、Kazuhiko Takai

  DOI：10.1016/j.tet.2008.01.145

  日期：2008.6

  With the aid of a directing group, an imine moiety, heteroaromatic compounds add to acetylenes in the presence of a catalytic amount of [ReBr(CO)(3)(THF)](2) at the adjacent position of the directing group regioselectively to give hydroarylation of the acetylenes in good to excellent yields. Similarly, heteroaromatic compounds react with acrylates and isocyanates to give the corresponding hydroarylation products under rhenium catalysis. (C) 2008 Elsevier Ltd. All rights reserved.