4,5,9,10,14,15-hexapropyl-2,7,12,17,29,31,32,33-octazaoctacyclo[16.10.1.13,6.18,11.113,16.122,25.019,28.021,26]tritriaconta-1,3,5,7,9,11(32),12,14,16,18(29),19,21(26),23,27-tetradecaene | 252269-71-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 4,5,9,10,14,15-hexapropyl-2,7,12,17,29,31,32,33-octazaoctacyclo[16.10.1.13,6.18,11.113,16.122,25.019,28.021,26]tritriaconta-1,3,5,7,9,11(32),12,14,16,18(29),19,21(26),23,27-tetradecaene
• CAS: 252269-71-9
• 化学式: C₄₃H₅₂N₈
• 分子量: 680.939
• InChiKey: VHRUWNLBMAXQNR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.69
• 重原子数：
  51.0
• 可旋转键数：
  12.0
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  108.92
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  4,5,9,10,14,15-hexapropyl-2,7,12,17,29,31,32,33-octazaoctacyclo[16.10.1.13,6.18,11.113,16.122,25.019,28.021,26]tritriaconta-1,3,5,7,9,11(32),12,14,16,18(29),19,21(26),23,27-tetradecaene 在 copper diacetate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以95%的产率得到
  参考文献：
  名称：

  Synthesis and ring opening metathetic polymerisation of porphyrazine benzonorbornadiene derivatives

  摘要：

  Benzonorbornadiene substituted porphyrazines are homo- and copolymerised (ROMP) with norbornene using Cl-2(Cy3P)(2)Ru=CHPh to provide dark-green and blue polymers. These novel materials have been characterised using GPC, UV-vis and EPR spectroscopy. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)01680-9
• 作为产物：
  描述：

  magnesium;4,5,9,10,14,15-hexapropyl-2,7,12,17,29,31-hexaza-32,33-diazanidaoctacyclo[16.10.1.13,6.18,11.113,16.122,25.019,28.021,26]tritriaconta-1(29),2,4,6,8,10,12,14,16(31),17,19,21(26),23,27-tetradecaene 在 三氟乙酸 作用下， 以98%的产率得到4,5,9,10,14,15-hexapropyl-2,7,12,17,29,31,32,33-octazaoctacyclo[16.10.1.13,6.18,11.113,16.122,25.019,28.021,26]tritriaconta-1,3,5,7,9,11(32),12,14,16,18(29),19,21(26),23,27-tetradecaene
  参考文献：
  名称：

  Synthesis and ring opening metathetic polymerisation of porphyrazine benzonorbornadiene derivatives

  摘要：

  Benzonorbornadiene substituted porphyrazines are homo- and copolymerised (ROMP) with norbornene using Cl-2(Cy3P)(2)Ru=CHPh to provide dark-green and blue polymers. These novel materials have been characterised using GPC, UV-vis and EPR spectroscopy. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)01680-9