Benzaldehyde, 4-(decyloxy)-2-hydroxy-,[[4-(decyloxy)-2-hydroxyphenyl]methylene]hydrazone, (E,E)- | 88787-61-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: Benzaldehyde, 4-(decyloxy)-2-hydroxy-,[[4-(decyloxy)-2-hydroxyphenyl]methylene]hydrazone, (E,E)-
• 英文别名: 4,4'-didecyloxy-2,2'-dihydroxybenzalazine；6,6'-(1E,1'E)-hydrazine-1,2-diylidenebis(methan-1-yl-1-ylidene)bis(3-decyloxy phenol)
• CAS: 88787-61-5
• 化学式: C₃₄H₅₂N₂O₄
• 分子量: 552.798
• InChiKey: JZJNGZAXLZJLTQ-JEVCVBCSSA-N

物化性质

• 沸点：
  661.2±55.0 °C(Predicted)
• 密度：
  1.02±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  9.59
• 重原子数：
  40.0
• 可旋转键数：
  23.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  83.64
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  4-(decyloxy)salicylaldehyde 在 肼 作用下， 以 乙醇 为溶剂， 以80 %的产率得到Benzaldehyde, 4-(decyloxy)-2-hydroxy-,[[4-(decyloxy)-2-hydroxyphenyl]methylene]hydrazone, (E,E)-
  参考文献：
  名称：

  对称苯并嗪的介晶行为和质子化诱导发射研究

  摘要：

  合成、表征了具有质子化诱导发射的棒状和聚链状对称苯并嗪，并研究了它们的热和光学行为。邻位缺少羟基的苯并嗪在固态或溶液中不显示发光。在 HCl（溶液或蒸气形式）存在下，这些化合物成为良好的发射体。吖嗪氮的质子化可能通过分子间相互作用阻碍聚集体的 NN 键旋转，这为观察到的发射特性提供了解释。质子化引起的发射是热可逆的。制备了具有AIE性质的4-烷氧基水杨醛衍生的苯扎嗪。对于这种带有-OH基团的化合物，光学性质不受酸性介质存在的影响。它表现出稳定的 SmC 相，通过 POM、DSC 和 XRD 进行表征。研究了近晶相内分子排列的发光能力。由于随着温度升高而发生的非辐射衰变以及阻止晶体中分子旋转的分子间氢键的丧失，晶体中强烈的黄绿色发射在相变时显着减少。

  DOI：

  10.1016/j.molstruc.2024.138571

文献信息

• The π–π interactions enhanced in salicylaldimines and salicylaldazines
  作者：Hsiu-Ming Kuo、Yu-Te Hsu、Yi-Wen Wang、Gene-Hsiang Lee、Chung K. Lai

  DOI：10.1016/j.tet.2015.07.049

  日期：2015.10

  Four new series of salicylaldazines 1 and salicylaldimines 2-4 were prepared, characterized and their mesomorphic properties were studied. The structures of all compounds were identified and confirmed by spectroscopic techniques such as H-1, C-13 NMR, MS and elemental analysis. Three single crystallographic structures of compounds la (n=3, 6) and 2 (n=3) were determined by X-ray analysis in order to correlate the molecular structures with the formation of mesophases. Crystallographic data indicated that the better mesomorphic properties might be controlled by CH-pi, pi-pi or/and H-bonds in such system. Except for crystalline compounds 4, all other compounds 1-3 showed mesomorphic behavior of nematic, smectic A or/and smectic C phases, which were characterized by differential scanning calorimetry, optical polarizing microscope and X-ray diffraction experiments. All compounds 1-4 showed yellow green photoluminescence in THF occurred at 519-521 nm. (C) 2015 Elsevier Ltd. All rights reserved.