5,11,17,23-Tetratert-butyl-26,28-bis[[1-[10-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxydecyl]triazol-4-yl]methoxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,27-diol | 1526905-08-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 5,11,17,23-Tetratert-butyl-26,28-bis[[1-[10-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxydecyl]triazol-4-yl]methoxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,27-diol
• 英文别名: 5,11,17,23-tetratert-butyl-26,28-bis[[1-[10-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxydecyl]triazol-4-yl]methoxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,27-diol
• CAS: 1526905-08-7
• 化学式: C₁₅₆H₂₂₂N₆O₁₆
• 分子量: 2437.51
• InChiKey: CYWPRMUTNYYRFL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  46.1
• 重原子数：
  178
• 可旋转键数：
  84
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  231
• 氢给体数：
  2
• 氢受体数：
  20

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 在 copper(ll) sulfate pentahydrate 、 sodium ascorbate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 10.0h， 以84%的产率得到5,11,17,23-Tetratert-butyl-26,28-bis[[1-[10-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxydecyl]triazol-4-yl]methoxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,27-diol
  参考文献：
  名称：

  Synthesis, complexation, and mesomorphism of novel calixarene-linked discotic triphenylene based on click chemistry

  摘要：

  The novel calixarene-linked discotic triphenylene 5a and 5b were synthesized in good yields via click chemistry. Structural and conformational characterization of new compounds had been achieved by NMR, MS, and elemental analysis. Their liquid crystalline behaviors before and after complexation were studied by polarizing optical microscopy, differential scanning calorimetry, and X-ray diffraction. The neat compounds 5a and 5b showed mesophase but the complexes of 5a and 5b with metallic salts exhibited no liquid crystal behaviors. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.11.008

文献信息

• Synthesis, complexation, and mesomorphism of novel calixarene-linked discotic triphenylene based on click chemistry
  作者：Biqiong Hong、Fafu Yang、Hongyu Guo、Ziyu Jiao

  DOI：10.1016/j.tetlet.2013.11.008

  日期：2014.1

  The novel calixarene-linked discotic triphenylene 5a and 5b were synthesized in good yields via click chemistry. Structural and conformational characterization of new compounds had been achieved by NMR, MS, and elemental analysis. Their liquid crystalline behaviors before and after complexation were studied by polarizing optical microscopy, differential scanning calorimetry, and X-ray diffraction. The neat compounds 5a and 5b showed mesophase but the complexes of 5a and 5b with metallic salts exhibited no liquid crystal behaviors. (C) 2013 Elsevier Ltd. All rights reserved.