| 1231716-75-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• CAS: 1231716-75-8
• 化学式: C₄₈H₄₇IOSi
• 分子量: 794.891
• InChiKey: DBAZYFHNOMNZIY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.01
• 重原子数：
  51.0
• 可旋转键数：
  6.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  20.23
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  、 在 copper(l) iodide 、 四(三苯基膦)钯 、 三乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 96.0h， 以84%的产率得到
  参考文献：
  名称：

  Macrocyclic Amphiphiles with 1,8-Anthrylene Fluorophores: Synthesis and Attempts toward Two-Dimensional Organization

  摘要：

  New macrocyclic amphiphiles with two or three integrated 1,8-anthrylenes have been synthesized by an iterative Sonogashira cross-coupling protocol. The final cyclization has been conducted with 80% yield under cuprous-free dilution conditions. Formation of a monolayer at the air/water interface has also been demonstrated. These results open the intriguing possibility to construct large 2D supramolecular/macromolecular systems for which unique photophysical and -chemical properties are expected.

  DOI：

  10.1021/ol100877g
• 作为产物：
  描述：

  [3,5-Bis(3-iodo-5-methylphenyl)phenyl]methanol 、 1-ethynyl-8-[(triisopropylsilyl)ethynyl]anthracene 在 copper(l) iodide 、 四(三苯基膦)钯 、 三乙胺 作用下， 以 甲苯 为溶剂， 反应 120.0h， 以41%的产率得到
  参考文献：
  名称：

  Macrocyclic Amphiphiles with 1,8-Anthrylene Fluorophores: Synthesis and Attempts toward Two-Dimensional Organization

  摘要：

  New macrocyclic amphiphiles with two or three integrated 1,8-anthrylenes have been synthesized by an iterative Sonogashira cross-coupling protocol. The final cyclization has been conducted with 80% yield under cuprous-free dilution conditions. Formation of a monolayer at the air/water interface has also been demonstrated. These results open the intriguing possibility to construct large 2D supramolecular/macromolecular systems for which unique photophysical and -chemical properties are expected.

  DOI：

  10.1021/ol100877g