5-[5-[5-[5-[5-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-4-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine | 1167988-13-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 双噻吩和低聚噻吩
• 英文名称: 5-[5-[5-[5-[5-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-4-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine
• 英文别名: 5-[5-[5-[5-[5-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-4-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine
• CAS: 1167988-13-7
• 化学式: C₄₂H₄₆O₁₀S₆
• 分子量: 903.217
• InChiKey: WJYROWIVDPKEOT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  58
• 可旋转键数：
  23
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  262
• 氢给体数：
  0
• 氢受体数：
  16

反应信息

• 作为反应物：
  描述：

  1,4-二(溴甲基)苯 、 5-[5-[5-[5-[5-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-4-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine 、 1,1-[1,4-phenylenebis(methylene)]bis-4,4'-pyridylpiridinium bis(hexafluorophosphate) 以 乙腈 为溶剂， 反应 168.0h， 以11%的产率得到
  参考文献：
  名称：

  From Thiophene [2]Rotaxane to Polythiophene Polyrotaxane

  摘要：

  The polythiophene polyrotaxane was synthesized through electrochemical polymerization of the [2]rotaxane consisting of the electron-rich dumbbell-shaped sexithiophene and the electron-deficient cyclophane of cyclobis(paraquat-p-phenylene). The optical and electrochemical property of the polythiophene polyrotaxane film was characterized. The material reported herein is attractive not only as a component for constructing the macromolecular machine but also as a new type of insulated molecular wire having donor-acceptor interaction between the macrocycle and the conductive polymer.

  DOI：

  10.1021/ja902992c
• 作为产物：
  描述：

  C₃₀H₃₆Br₂O₆S₄ 、 三丁基(2,3-二氢噻吩并[3,4-b]-[1,4]二恶英-5-基)锡烷 在 四(三苯基膦)钯 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 14.0h， 以94%的产率得到5-[5-[5-[5-[5-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-4-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-[2-(2-ethoxyethoxy)ethoxymethyl]thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine
  参考文献：
  名称：

  From Thiophene [2]Rotaxane to Polythiophene Polyrotaxane

  摘要：

  The polythiophene polyrotaxane was synthesized through electrochemical polymerization of the [2]rotaxane consisting of the electron-rich dumbbell-shaped sexithiophene and the electron-deficient cyclophane of cyclobis(paraquat-p-phenylene). The optical and electrochemical property of the polythiophene polyrotaxane film was characterized. The material reported herein is attractive not only as a component for constructing the macromolecular machine but also as a new type of insulated molecular wire having donor-acceptor interaction between the macrocycle and the conductive polymer.

  DOI：

  10.1021/ja902992c

文献信息

• ELECTRICALLY CONDUCTIVE POLYROTAXANE
  申请人：Ikeda Taichi

  公开号：US20120083582A1

  公开（公告）日：2012-04-05

  The conductive polyrotaxane of the present invention contains an electron-accepting cyclic molecule in each of its repeating unit. Since the electron-accepting cyclic molecule remains stable because of molecular interaction with a π-conjugated oligomer molecule, the electron-accepting cyclic molecule is not dissociated during rotaxane polymerization reaction, and thus a conductive polyrotaxane of stable quality can be obtained.
• From Thiophene [2]Rotaxane to Polythiophene Polyrotaxane
  作者：Taichi Ikeda、Masayoshi Higuchi、Dirk G. Kurth

  DOI：10.1021/ja902992c

  日期：2009.7.8

  The polythiophene polyrotaxane was synthesized through electrochemical polymerization of the [2]rotaxane consisting of the electron-rich dumbbell-shaped sexithiophene and the electron-deficient cyclophane of cyclobis(paraquat-p-phenylene). The optical and electrochemical property of the polythiophene polyrotaxane film was characterized. The material reported herein is attractive not only as a component for constructing the macromolecular machine but also as a new type of insulated molecular wire having donor-acceptor interaction between the macrocycle and the conductive polymer.