p-<2>cubyl | 116503-50-5

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: p-<2>cubyl
• 英文别名: bicubyl；Cubylcubane；1-cuban-1-ylcubane
• CAS: 116503-50-5
• 化学式: C₁₆H₁₄
• 分子量: 206.287
• InChiKey: QAKDAQSKYVARDS-UHFFFAOYSA-N

物化性质

• 密度：
  2.167±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  12.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  1,4'-diiodo-p-<2>cubyl 在 甲醇 、 叔丁基锂 作用下， 生成 p-<2>cubyl
  参考文献：
  名称：

  Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)¹

  摘要：

  On treatment with an organolithium 1,4-diiodocubane generates cubane-1,4-diyl, a highly reactive species, shown here to be a versatile precursor to numerous aryl substituted cubanes, available now for the first time in high yield. The diyl is demonstrated to provide a good route to bicubyl and its derivatives. A kind of "living polymerization" of the diyl is developed to give the p-[n]cubyls. These oligomers are rigid rods made up of cubanes linked together at the 1 and 4 positions, each cubane adding similar to 4.15 Angstrom to the length. The properties of these rods, some more than 15 Angstrom long, are discussed, as are methods for modifying their solubility. X-ray crystallographic analyses of some of these compounds an presented, with emphasis on packing parameters.

  DOI：

  10.1021/ja983441f

文献信息

• The reactions of 1,4-dihalocubanes with organolithiums. The case for 1,4-cubadiyl
  作者：Philip E. Eaton、John Tsanaktsidis

  DOI：10.1021/ja00158a063

  日期：1990.1

  La lithiation suivie par une carbomethoxylation de dihalogeno-1,4 cubane fournit des derives de cubanecarboxylate-1, cubanedicarboxylate-1,4, de dicubyle-1,4' carboxylate-1, dicubyle-1,4' dicarboxylate-1,4 de methyle ou dimethyle

  La lithiation suvie par une carbomethoxylation de dihalogeno-1,4 cubane Fournit des甲基或二甲基
• Nitration of Organolithiums and Grignards with Dinitrogen Tetroxide:  Success at Melting Interfaces
  作者：Keita Tani、Kirill Lukin、Philip E. Eaton

  DOI：10.1021/ja963658e

  日期：1997.2.1
• Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, <i>p</i>-[<i>n</i>]Cubyls, and Cubane-Separated Bis(arenes)¹
  作者：Philip E. Eaton、Kakumanu Pramod、Todd Emrick、Richard Gilardi

  DOI：10.1021/ja983441f

  日期：1999.5.1

  On treatment with an organolithium 1,4-diiodocubane generates cubane-1,4-diyl, a highly reactive species, shown here to be a versatile precursor to numerous aryl substituted cubanes, available now for the first time in high yield. The diyl is demonstrated to provide a good route to bicubyl and its derivatives. A kind of "living polymerization" of the diyl is developed to give the p-[n]cubyls. These oligomers are rigid rods made up of cubanes linked together at the 1 and 4 positions, each cubane adding similar to 4.15 Angstrom to the length. The properties of these rods, some more than 15 Angstrom long, are discussed, as are methods for modifying their solubility. X-ray crystallographic analyses of some of these compounds an presented, with emphasis on packing parameters.