1-(3,4,5-Tris-dodecyloxy-phenyl)-ethanol | 180726-40-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1-(3,4,5-Tris-dodecyloxy-phenyl)-ethanol
• 英文别名: 1-(3,4,5-Tridodecoxyphenyl)ethanol
• CAS: 180726-40-3
• 化学式: C₄₄H₈₂O₄
• 分子量: 675.133
• InChiKey: CBEYHBAAUBIFPM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  18.1
• 重原子数：
  48
• 可旋转键数：
  37
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  47.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-(3,4,5-Tris-dodecyloxy-phenyl)-ethanol 在 正丁基锂 作用下， 以 氯仿 为溶剂， 反应 5.17h， 生成 (E)-1-(2-bromophenyl)-2-(3,4,5-tris(dodecyloxy)phenyl)propene
  参考文献：
  名称：

  Belt-Shaped Cyclophanes via Photodimerization of Phenanthro-Condensed [18]Annulenes

  摘要：

  A novel cyclophane type can be obtained by photocyclodimerization reactions of condensed [18]annulenes. Quantitative yields in pure columnar liquid crystalline phases and high yields in 10(-6) M solution raise the inquiry about the unusual dimerization mechanism in this process. Concentration-dependent measurements of the emission and excitation spectra and the fluorescence lifetimes reveal a ground state aggregation in solution even at very low concentrations.

  DOI：

  10.1021/jo960572v
• 作为产物：
  描述：

  甲基氯化镁 、 3,4,5-三(十二烷氧基)苯甲醛 以 四氢呋喃 、 乙醚 为溶剂， 反应 1.0h， 以98%的产率得到1-(3,4,5-Tris-dodecyloxy-phenyl)-ethanol
  参考文献：
  名称：

  Belt-Shaped Cyclophanes via Photodimerization of Phenanthro-Condensed [18]Annulenes

  摘要：

  A novel cyclophane type can be obtained by photocyclodimerization reactions of condensed [18]annulenes. Quantitative yields in pure columnar liquid crystalline phases and high yields in 10(-6) M solution raise the inquiry about the unusual dimerization mechanism in this process. Concentration-dependent measurements of the emission and excitation spectra and the fluorescence lifetimes reveal a ground state aggregation in solution even at very low concentrations.

  DOI：

  10.1021/jo960572v

文献信息

• Belt-Shaped Cyclophanes via Photodimerization of Phenanthro-Condensed [18]Annulenes
  作者：Klaus Müller、Herbert Meier、H. Bouas-Laurent、J. P. Desvergne

  DOI：10.1021/jo960572v

  日期：1996.1.1

  A novel cyclophane type can be obtained by photocyclodimerization reactions of condensed [18]annulenes. Quantitative yields in pure columnar liquid crystalline phases and high yields in 10(-6) M solution raise the inquiry about the unusual dimerization mechanism in this process. Concentration-dependent measurements of the emission and excitation spectra and the fluorescence lifetimes reveal a ground state aggregation in solution even at very low concentrations.