N,N-bis((1-(3-(2,8,9-trioxa-5-aza-1-silatranyl)propyl)-1H-1,2,3-triazol-4-yl)methyl)-2-chlorobenzenamine

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N,N-bis((1-(3-(2,8,9-trioxa-5-aza-1-silatranyl)propyl)-1H-1,2,3-triazol-4-yl)methyl)-2-chlorobenzenamine
• 英文别名: 4-chloro-N,N-bis[[1-[3-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yl)propyl]triazol-4-yl]methyl]aniline
• 化学式: C₃₀H₄₆ClN₉O₆Si₂
• 分子量: 720.376
• InChiKey: YFQDUMANQZUTRP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.15
• 重原子数：
  48
• 可旋转键数：
  13
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  127
• 氢给体数：
  0
• 氢受体数：
  13

反应信息

• 作为产物：
  描述：

  3-氯丙基三乙氧基硅烷 在 sodium azide 、 溴化三(三苯基磷)铜 、 三乙胺 、 potassium hydroxide 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 26.0h， 生成 N,N-bis((1-(3-(2,8,9-trioxa-5-aza-1-silatranyl)propyl)-1H-1,2,3-triazol-4-yl)methyl)-2-chlorobenzenamine
  参考文献：
  名称：

  Three-step pathway towards bis(1,2,3-triazolyl-γ-propylsilatranes) as Cu2+ fluorescent sensor, via ‘Click Silylation’

  摘要：

  A series of substituted aniline derivatized bis(1,2,3-triazolyl-gamma-propylsilatranes) 3a-3f were designed in good yield from their triethoxysilane analogues via Cu(I) 'Click Silylation'. All the silatranes 3a-3f were characterized by IR, NMR (H-1, C-13) and HRMS studies. All these compounds were explored for their thermal stability by thermogravimetric analysis (TGA)/differential thermal analysis (DTA)/differential scanning calorimetry (DSC) study and electronic properties by UV-vis spectroscopy and fluorescence study. The binding of silatranes 3a-3f to Cu2+ ion proves them to be good chemosensor. These silatranes were subjected to time dependent hydrolysis under normal atmospheric conditions. IR spectroscopic data support hydrolytic instability of 3a, 3c and 3e. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.03.043

文献信息

• Three-step pathway towards bis(1,2,3-triazolyl-γ-propylsilatranes) as Cu2+ fluorescent sensor, via ‘Click Silylation’
  作者：Gurjaspreet Singh、Jandeep Singh、Satinderpal Singh Mangat、Aanchal Arora

  DOI：10.1016/j.tetlet.2014.03.043

  日期：2014.4

  A series of substituted aniline derivatized bis(1,2,3-triazolyl-gamma-propylsilatranes) 3a-3f were designed in good yield from their triethoxysilane analogues via Cu(I) 'Click Silylation'. All the silatranes 3a-3f were characterized by IR, NMR (H-1, C-13) and HRMS studies. All these compounds were explored for their thermal stability by thermogravimetric analysis (TGA)/differential thermal analysis (DTA)/differential scanning calorimetry (DSC) study and electronic properties by UV-vis spectroscopy and fluorescence study. The binding of silatranes 3a-3f to Cu2+ ion proves them to be good chemosensor. These silatranes were subjected to time dependent hydrolysis under normal atmospheric conditions. IR spectroscopic data support hydrolytic instability of 3a, 3c and 3e. (C) 2014 Elsevier Ltd. All rights reserved.