6,18-Dinitro-3,15-diphenyl-10,22-diazahexacyclo[11.11.1.02,11.04,9.014,23.016,21]pentacosa-2,4(9),5,7,10,14,16(21),17,19,22-decaene | 899443-76-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 6,18-Dinitro-3,15-diphenyl-10,22-diazahexacyclo[11.11.1.02,11.04,9.014,23.016,21]pentacosa-2,4(9),5,7,10,14,16(21),17,19,22-decaene
• 英文别名: 6,18-dinitro-3,15-diphenyl-10,22-diazahexacyclo[11.11.1.02,11.04,9.014,23.016,21]pentacosa-2,4(9),5,7,10,14,16(21),17,19,22-decaene
• CAS: 899443-76-6
• 化学式: C₃₅H₂₄N₄O₄
• 分子量: 564.6
• InChiKey: GBJLERVNAMRHTA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  43
• 可旋转键数：
  2
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  117
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  6,18-Dinitro-3,15-diphenyl-10,22-diazahexacyclo[11.11.1.02,11.04,9.014,23.016,21]pentacosa-2,4(9),5,7,10,14,16(21),17,19,22-decaene 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 三氟甲苯 为溶剂， 以75%的产率得到7α,15α-dibromo-2,10-dinitro-8,16-diphenyl-6,7,14,15-tetrahydro-7,15-methanocycloocta[1,2-b:5,6-b']diquinolie
  参考文献：
  名称：

  Effect of Adding Bromine Sensors to the Central Linker of New Diquinoline Derivative

  摘要：

  Designing a selective lattice inclusion host had been challenging and fulfilling. Using 3 as a building block, we introduced bromine sensors to the central linker and investigate its effect on inclusion properties. An unexpected result was obtained when a pure sample of the diquinoline derivative 4 was crystallised from tetrahydrofuran. Unlike host 3, the diquinoline 4 did not include any guest molecules.

  DOI：

  10.1080/15421400802406489
• 作为产物：
  描述：

  二环[3.3.1]壬-3,7-二酮 、 2-氨基-5-硝基二苯甲酮 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 生成 6,18-Dinitro-3,15-diphenyl-10,22-diazahexacyclo[11.11.1.02,11.04,9.014,23.016,21]pentacosa-2,4(9),5,7,10,14,16(21),17,19,22-decaene
  参考文献：
  名称：

  Effect of Adding Bromine Sensors to the Central Linker of New Diquinoline Derivative

  摘要：

  Designing a selective lattice inclusion host had been challenging and fulfilling. Using 3 as a building block, we introduced bromine sensors to the central linker and investigate its effect on inclusion properties. An unexpected result was obtained when a pure sample of the diquinoline derivative 4 was crystallised from tetrahydrofuran. Unlike host 3, the diquinoline 4 did not include any guest molecules.

  DOI：

  10.1080/15421400802406489

文献信息

• Effect of Adding Bromine Sensors to the Central Linker of New Diquinoline Derivative
  作者：Solhe F. Alshahateet

  DOI：10.1080/15421400802406489

  日期：2008.10.27

  Designing a selective lattice inclusion host had been challenging and fulfilling. Using 3 as a building block, we introduced bromine sensors to the central linker and investigate its effect on inclusion properties. An unexpected result was obtained when a pure sample of the diquinoline derivative 4 was crystallised from tetrahydrofuran. Unlike host 3, the diquinoline 4 did not include any guest molecules.