| 1580465-25-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• CAS: 1580465-25-3
• 化学式: C₂₈H₂₁N₂*Cl
• 分子量: 420.941
• InChiKey: QDEITJRKIXMHCX-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  3.36
• 重原子数：
  31.0
• 可旋转键数：
  4.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  16.77
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  、 碘甲烷 以 乙腈 为溶剂， 反应 48.0h， 以83%的产率得到
  参考文献：
  名称：

  Wholly-rigid rod–rod amphiphiles: synthesis, crystal structures, and self-assembling behavior in water

  摘要：

  A series of fully rigid rod-rod type amphiphilic molecules have been constructed by using 4,4'-bipyridin1-ium or 4,4'-bipyridin-1,1'-diium (viologen) as a hydrophilic segment and phenyl, biphenyl or para-tertphenyl as a hydrophobic unit. The crystal structures of four of the molecules have been elucidated. TEM, SEM, AFM, and DLS experiments revealed that these stiff amphiphiles could self-assemble into diverse architectures, including spherical micelles, ultra-long straight nanofibers (>1 mm), and nanotubes in water, which depend on the hydrophilic/hydrophobic fraction ratios of the molecules. (c) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2014.02.029
• 作为产物：
  描述：

  4,4'-联吡啶 以 乙醇 、 丙酮 为溶剂， 反应 61.0h， 生成
  参考文献：
  名称：

  Wholly-rigid rod–rod amphiphiles: synthesis, crystal structures, and self-assembling behavior in water

  摘要：

  A series of fully rigid rod-rod type amphiphilic molecules have been constructed by using 4,4'-bipyridin1-ium or 4,4'-bipyridin-1,1'-diium (viologen) as a hydrophilic segment and phenyl, biphenyl or para-tertphenyl as a hydrophobic unit. The crystal structures of four of the molecules have been elucidated. TEM, SEM, AFM, and DLS experiments revealed that these stiff amphiphiles could self-assemble into diverse architectures, including spherical micelles, ultra-long straight nanofibers (>1 mm), and nanotubes in water, which depend on the hydrophilic/hydrophobic fraction ratios of the molecules. (c) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2014.02.029