1-(((2,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecin-15-yl)imino)methyl)naphthalen-2-ol | 217973-94-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-(((2,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecin-15-yl)imino)methyl)naphthalen-2-ol
• 英文别名: 1-(2,5,8,11,14-Pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yliminomethyl)naphthalen-2-ol
• CAS: 217973-94-9
• 化学式: C₂₅H₂₇NO₆
• 分子量: 437.492
• InChiKey: CYHUDCWKZYXZQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  32
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  78.7
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  4'-氨基苯并-15-冠-5-醚 、 2-羟基-1-萘甲醛 以 乙醇 为溶剂， 以80%的产率得到1-(((2,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecin-15-yl)imino)methyl)naphthalen-2-ol
  参考文献：
  名称：

  Crown ether-containing N-salicylidene aniline derivatives: synthesis, characterization and optical properties

  摘要：

  15-Crown-5 ether-containing N-salicylidene aniline derivatives of the common formula benzo-15-crown-5-NCH–(2-OH-aryl) [aryl = C6H4 (1), 5-ClC6H3 (2), 5-BrC6H3 (3), C10H6 (4)] have been synthesized and characterized by elemental analysis, NMR, diffuse reflectance, fluorescence, IR and Raman spectroscopies. The crystal structure of 1, elucidated by X-ray diffraction, is stabillized by an intramolecular hydrogen bond and intermolecular π⋯π stacking interactions. Molecules 1–3 are thermochromic and show the presence of a mixture of enol and cis-keto forms in the solid state at room temperature. Compound 1 displays photochromism upon irradiation at 546 nm, which is reversible and exhibits relatively quick back thermal relaxation.

  DOI：

  10.1039/c2ce25600b

文献信息

• Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission
  作者：Luminita Marin、Arie van der Lee、Sergiu Shova、Adina Arvinte、Mihail Barboiu

  DOI：10.1039/c5nj01052g

  日期：——

  Imine compounds containing rigid cores and soft aliphatic tails have been designed to generate molecular glasses and large crystals displaying aggregation-induced emission, which makes them interesting candidates for optoelectronic applications.

  含有刚性核心和软性脂肪尾的亚胺化合物已被设计用于生成分子玻璃和大晶体，这些分子玻璃和大晶体具有聚集诱导发光的特性，使它们成为光电应用的有趣候选材料。