Tetramethyl 1,8-didodecoxy-15,16-dioxatetracyclo[6.6.2.02,7.09,14]hexadeca-2(7),3,5,9(14),10,12-hexaene-4,5,11,12-tetracarboxylate | 164018-89-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: Tetramethyl 1,8-didodecoxy-15,16-dioxatetracyclo[6.6.2.02,7.09,14]hexadeca-2(7),3,5,9(14),10,12-hexaene-4,5,11,12-tetracarboxylate
• CAS: 164018-89-7
• 化学式: C₄₆H₆₆O₁₂
• 分子量: 811.023
• InChiKey: BNBAABHGXCVXTP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.8
• 重原子数：
  58
• 可旋转键数：
  32
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  142
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  tetramethyl-9,10-didodecyloxyanthracene-2,3,6,7-tetracarboxylate 以 氯仿 为溶剂， 反应 8.0h， 以64%的产率得到Tetramethyl 1,8-didodecoxy-15,16-dioxatetracyclo[6.6.2.02,7.09,14]hexadeca-2(7),3,5,9(14),10,12-hexaene-4,5,11,12-tetracarboxylate
  参考文献：
  名称：

  Design and synthesis of complementary components for the formation of self-assembled supramolecular rigid rods

  摘要：

  The complementary components AP(2) and AU(2), resulting respectively from the linking of diacylaminopyridine and uracil derivatives to an anthracenic core, have been designed in order to self-assemble, through hydrogen bonding, into polymeric supramolecular rigid rods (AP(2), AU(2))(n). The synthesis of these compounds is reported.

  DOI：

  10.1016/0040-4020(94)01076-c

文献信息

• Design and synthesis of complementary components for the formation of self-assembled supramolecular rigid rods
  作者：Mitsu Kotera、Jean-Marie Lehn、Jean-Pierre Vigneron

  DOI：10.1016/0040-4020(94)01076-c

  日期：1995.2

  The complementary components AP(2) and AU(2), resulting respectively from the linking of diacylaminopyridine and uracil derivatives to an anthracenic core, have been designed in order to self-assemble, through hydrogen bonding, into polymeric supramolecular rigid rods (AP(2), AU(2))(n). The synthesis of these compounds is reported.