1,1',1'',1''',1'''',1''''',1'''''',1'''''''-(((2R,4R,6S,8S)-2,4,6,8-tetra(naphthalen-1-yl)-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-14,16,34,36,54,56,74,76-octayl)octakis(oxy))octakis(N,N,N',N'-tetraethylphosphanediamine) | 1146206-87-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1,1',1'',1''',1'''',1''''',1'''''',1'''''''-(((2R,4R,6S,8S)-2,4,6,8-tetra(naphthalen-1-yl)-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-14,16,34,36,54,56,74,76-octayl)octakis(oxy))octakis(N,N,N',N'-tetraethylphosphanediamine)
• CAS: 1146206-87-2
• 化学式: C₁₃₂H₂₀₀N₁₆O₈P₈
• 分子量: 2386.93
• InChiKey: RBVBJVZXBBLSQS-QHKMQPJBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  35.65
• 重原子数：
  164.0
• 可旋转键数：
  68.0
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  125.68
• 氢给体数：
  0.0
• 氢受体数：
  24.0

反应信息

• 作为产物：
  描述：

  (2R,4R,6S,8S)-2,4,6,8-tetra(naphthalen-1-yl)-1,3,5,7(1,3)-tetrabenzenacyclooctaphan-14,16,34,36,54,56,74,76-octaol 、 六乙基亚磷酸胺 以 1,4-二氧六环 为溶剂， 反应 23.0h， 以47%的产率得到1,1',1'',1''',1'''',1''''',1'''''',1'''''''-(((2R,4R,6S,8S)-2,4,6,8-tetra(naphthalen-1-yl)-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-14,16,34,36,54,56,74,76-octayl)octakis(oxy))octakis(N,N,N',N'-tetraethylphosphanediamine)
  参考文献：
  名称：

  Sterically oriented synthesis and structure of new perphosphorylated resorcinarenes

  摘要：

  Tetraarylresorcinarenes in a chair conformation of C-2h symmetry were synthesized by sterically oriented condensation of aromatic aldehydes with resorcinol and 2-methylresorcinol. By further phosphorylation of resorcinarenes with phosphorous amides perphosphorylated derivatives were obtained with rctt configuration of substituents at internuclear methylidene bridges. Structure of these compounds was proved using NMR spectroscopy and X-ray diffraction analysis.

  DOI：

  10.1134/s1070363208030092