28,34,40,45-Tetratert-butyl-3,24-dioxa-6,7,8,19,20,21-hexazaundecacyclo[24.15.7.610,17.15,8.119,22.132,36.143,47.02,38.011,16.025,30.052,57]octapentaconta-1,5(58),6,10(57),11,13,15,17(52),20,22(51),25,27,29,32(50),33,35,38,40,43,45,47(49),53,55-tricosaene-49,50-diol | 1056466-05-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 28,34,40,45-Tetratert-butyl-3,24-dioxa-6,7,8,19,20,21-hexazaundecacyclo[24.15.7.610,17.15,8.119,22.132,36.143,47.02,38.011,16.025,30.052,57]octapentaconta-1,5(58),6,10(57),11,13,15,17(52),20,22(51),25,27,29,32(50),33,35,38,40,43,45,47(49),53,55-tricosaene-49,50-diol
• CAS: 1056466-05-7
• 化学式: C₆₆H₇₂N₆O₄
• 分子量: 1013.34
• InChiKey: MVFZEIOUILOVHC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16
• 重原子数：
  76
• 可旋转键数：
  4
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  120
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  5,11,17,23-tetra-tert-butyl-25,27-dihydroxy-26,28-dipropargylcalix[4]arene 、 9,10-bis(azidomethyl)anthracene 在 triethylphosphite copper(I) iodide complex 、 N,N-二异丙基乙胺 作用下， 以 甲苯 为溶剂， 反应 1.0h， 以34%的产率得到28,34,40,45-Tetratert-butyl-3,24-dioxa-6,7,8,19,20,21-hexazaundecacyclo[24.15.7.610,17.15,8.119,22.132,36.143,47.02,38.011,16.025,30.052,57]octapentaconta-1,5(58),6,10(57),11,13,15,17(52),20,22(51),25,27,29,32(50),33,35,38,40,43,45,47(49),53,55-tricosaene-49,50-diol
  参考文献：
  名称：

  Synthesis of Calixarene-Based Cavitands and Nanotubes by Click Chemistry

  摘要：

  The synthesis of a variety of calixarene-based cavitands (capped and functional calixarenes) and calix nanotubes is easily performed in good to high yields using "click chemistry" methodology through the Cu(I)-catalyzed ligation of adequate bis-alkyne and bis-azide derivatives.

  DOI：

  10.1021/jo801325c