2,5-bis(bromomethyl)benzyl pent-4-ynoate | 1107608-79-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2,5-bis(bromomethyl)benzyl pent-4-ynoate
• CAS: 1107608-79-6
• 化学式: C₁₄H₁₄Br₂O₂
• 分子量: 374.072
• InChiKey: CJUFPHQGAFZUPM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.93
• 重原子数：
  18.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  2,5-bis(bromomethyl)benzyl pent-4-ynoate 、 1,1-[1,4-phenylenebis(methylene)]bis-4,4'-pyridylpiridinium bis(hexafluorophosphate) 在 1,5-bis(2-(2-methoxyethoxy)ethoxy)naphthalene 、 ammonium hexafluorophosphate 作用下， 以 N,N-二甲基甲酰胺 、 水 为溶剂， 反应 240.0h， 以24%的产率得到
  参考文献：
  名称：

  Synthesis of a polypseudorotaxane, polyrotaxane, and polycatenane using ‘click’ chemistry

  摘要：

  The synthesis of a polypseudorotaxane, polyrotaxane, and polycatenane containing the electron-deficient cyclophane cyclobis(paraquat-p-phenylene) (CBPQT(4+)) subunit in the side chain is described. These interlocked supramolecular polymers have been prepared from an azide-functionalized polystyrene derivative and an acetylene-functionalized [2]rotaxane, [2]catenane and their parent tetracationic cyclophane via Cu(I)-catalyzed 1,3 dipolar cycloadditions ('click chemistry'). The synthesis and characterization of the polymers and intermediates has been described using IR, H-1 NMR, UV spectroscopies, and voltammetry. We have shown that the CBPQT(4+) unit of the side chain polystyrene derivative has the ability to reversibly undergo complexation with a complementary dialkoxynaphthatene derivative. (C) 2008 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tet.2008.10.005
• 作为产物：
  描述：

  2,5-bis(bromomethyl)benzyl alcohol 、 炔丙基脲 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 6.0h， 以68%的产率得到2,5-bis(bromomethyl)benzyl pent-4-ynoate
  参考文献：
  名称：

  Synthesis of a polypseudorotaxane, polyrotaxane, and polycatenane using ‘click’ chemistry

  摘要：

  The synthesis of a polypseudorotaxane, polyrotaxane, and polycatenane containing the electron-deficient cyclophane cyclobis(paraquat-p-phenylene) (CBPQT(4+)) subunit in the side chain is described. These interlocked supramolecular polymers have been prepared from an azide-functionalized polystyrene derivative and an acetylene-functionalized [2]rotaxane, [2]catenane and their parent tetracationic cyclophane via Cu(I)-catalyzed 1,3 dipolar cycloadditions ('click chemistry'). The synthesis and characterization of the polymers and intermediates has been described using IR, H-1 NMR, UV spectroscopies, and voltammetry. We have shown that the CBPQT(4+) unit of the side chain polystyrene derivative has the ability to reversibly undergo complexation with a complementary dialkoxynaphthatene derivative. (C) 2008 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tet.2008.10.005