(9ci)-1H-苯并咪唑-5,6-二甲腈 | 267642-46-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 中文名称: (9ci)-1H-苯并咪唑-5,6-二甲腈
• 英文名称: 5,6-dicyanobenzimidazole
• 英文别名: 1H-Benzimidazole-5,6-dicarbonitrile
• CAS: 267642-46-6
• 化学式: C₉H₄N₄
• mdl: MFCD18807892
• 分子量: 168.158
• InChiKey: SSHZLNHGCHDFMP-UHFFFAOYSA-N

物化性质

• 沸点：
  591.5±35.0 °C(Predicted)
• 密度：
  1.44±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  76.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (9ci)-1H-苯并咪唑-5,6-二甲腈 在 lithium 作用下， 以 戊醇 为溶剂， 反应 6.0h， 以43.5%的产率得到tetra(4,5-benzimidazole)porphyrazine
  参考文献：
  名称：

  Kudrik; Shaposhnikov; Balakirev, Russian Journal of General Chemistry, 1999, vol. 69, # 8, p. 1321 - 1324

  摘要：

  DOI：
• 作为产物：
  描述：

  4-氨基-5-硝基酞腈 在 盐酸 、 tin(ll) chloride 作用下， 以 水 为溶剂， 反应 2.33h， 生成 (9ci)-1H-苯并咪唑-5,6-二甲腈
  参考文献：
  名称：

  Kudrik; Shaposhnikov; Balakirev, Russian Journal of General Chemistry, 1999, vol. 69, # 8, p. 1321 - 1324

  摘要：

  DOI：

文献信息

• Substituted benzazoloporphyrazines for polymerization and surface attachment and articles formed therefrom
  申请人：Youngblood W. Justin

  公开号：US20110015388A1

  公开（公告）日：2011-01-20

  The present invention provides an article of manufacture formed from a substrate and a benzazoloporphyrazine bound to the substrate. The article may take a variety of different forms and may be for example an electrochromic display, a molecular capacitor, a battery, a solar cell, or a molecular memory device. Methods of making such articles, along with compounds, methods and intermediates useful for making such benzazoloporphyrazines, are also described.

  本发明提供了一种由基板和与基板结合的苯并咔唑卟啉制成的制品。该制品可以采用各种不同形式，例如电致变色显示器、分子电容器、电池、太阳能电池或分子存储器件。还描述了制造这种制品的方法，以及用于制造这种苯并咔唑卟啉的化合物、方法和中间体。
• SUBSTITUTED BENZAZOLOPORPHYRAZINES FOR POLYMERIZATION AND SURFACE ATTACHMENT AND ARTICLES FORMED THEREFROM
  申请人：Youngblood W. Justin

  公开号：US20120101243A1

  公开（公告）日：2012-04-26

  The present invention provides an article of manufacture formed from a substrate and a benzazoloporphyrazine bound to the substrate. The article may take a variety of different forms and may be for example an electrochromic display, a molecular capacitor, a battery, a solar cell, or a molecular memory device. Methods of making such articles, along with compounds, methods and intermediates useful for making such benzazoloporphyrazines, are also described.

  本发明提供了一种由基底和结合在基底上的苯并咪唑卟啉制成的制品。该制品可以采取多种不同的形式，例如电致变色显示器、分子电容器、电池、太阳能电池或分子记忆装置等。还描述了制造这种制品的方法，以及用于制造这种苯并咪唑卟啉的化合物、方法和中间体。
• Color-Coded Ligands: Tracking the Catalyst using Highly Pigmented Porphyrazine Ligands in Biphasic Reactions
  作者：Mmboneni Tshivhase、D. Bradley G. Williams

  DOI：10.1021/om501094p

  日期：2014.12.22

  We demonstrate the concept that highly colored imidazolium porphyrazine ligands and complexes may be useful for visualizing the location of a catalyst and/or ligand. This was analytically demonstrated by the application of UV-vis spectrophotometry to detect the ligand and ICP-OES spectroscopy for quantification of the Pd in the biphasic systems. In the first instance, a toluene/water system was used, in which the complex and ligand preferred the organic phase. Water-soluble substrates were made to react under these conditions by employing the complexes as catalysts in Heck and Suzuki C-C bond forming reactions. In the second instance, an ionic liquid containing biphasic mixture was used, in which the ligand/catalyst was retained in the ionic liquid. Catalyst recycling experiments were met with limited success.
• US4258170A
  申请人：——

  公开号：US4258170A

  公开（公告）日：1981-03-24
• US7919770B2
  申请人：——

  公开号：US7919770B2

  公开（公告）日：2011-04-05