| 1336875-36-5

• 分子结构分类: 有机化合物 - 有机杂环化合物
• CAS: 1336875-36-5
• 化学式: C₅₆H₅₀N₆O₈
• 分子量: 935.048
• InChiKey: NILPNUHIDKQMEZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.34
• 重原子数：
  70.0
• 可旋转键数：
  12.0
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  135.26
• 氢给体数：
  0.0
• 氢受体数：
  14.0

反应信息

• 作为反应物：
  描述：

  在 盐酸 作用下， 以 甲醇 、 氯仿 、 水 为溶剂， 反应 12.0h， 以93%的产率得到12,13,14,37,38,39-Hexazaundecacyclo[39.7.1.12,10.112,15.117,25.126,34.136,39.03,8.019,24.027,32.043,48]tetrapentaconta-1(49),2(54),3,5,7,9,13,15(53),17,19,21,23,25(52),26(51),27,29,31,33,36(50),37,41,43,45,47-tetracosaene-49,51,52,54-tetrol
  参考文献：
  名称：

  A novel BINOL-based cyclophane via click chemistry: synthesis and its applications for sensing silver ions

  摘要：

  A novel BINOL-based cyclophane 1 incorporating two triazole moieties was synthesized via click chemistry and characterized. Among the metal ions screened, only Ag+ was found to have the ability to quench the fluorescence of 1 in methanol solution. The 1:1 binding mode of 1-Ag+ was confirmed. The competitive experiment showed that compound 1 can be used as a specific fluorescent sensor for Ag+ over a wide range of competing cations. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.07.050
• 作为产物：
  描述：

  (S)-3,3'-bis(chloromethyl)-2,2'-bis(methoxymethoxy)-1,1'-binaphthyl 在 甲醇 、 potassium fluoride 、 copper(l) iodide 、 四丁基碘化铵 、 potassium carbonate 、 copper(II) sulfate 、 sodium ascorbate 作用下， 以 四氢呋喃 、 水 、 乙腈 、 叔丁醇 为溶剂， 反应 140.0h， 生成
  参考文献：
  名称：

  A novel BINOL-based cyclophane via click chemistry: synthesis and its applications for sensing silver ions

  摘要：

  A novel BINOL-based cyclophane 1 incorporating two triazole moieties was synthesized via click chemistry and characterized. Among the metal ions screened, only Ag+ was found to have the ability to quench the fluorescence of 1 in methanol solution. The 1:1 binding mode of 1-Ag+ was confirmed. The competitive experiment showed that compound 1 can be used as a specific fluorescent sensor for Ag+ over a wide range of competing cations. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.07.050