methyl 4-<2-(1H-imidazol-1-yl)-ethoxy>-benzoate | 75912-98-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: methyl 4-<2-(1H-imidazol-1-yl)-ethoxy>-benzoate
• 英文别名: dazoxiben；Methyl 4-(2-imidazol-1-ylethoxy)benzoate
• CAS: 75912-98-0
• 化学式: C₁₃H₁₄N₂O₃
• mdl: MFCD20928270
• 分子量: 246.266
• InChiKey: FFPUGLIKAZPIRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  53.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  methyl 4-<2-(1H-imidazol-1-yl)-ethoxy>-benzoate 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 反应 17.0h， 以88%的产率得到[4-(2-咪唑-1-基乙氧基)苯基]甲醇
  参考文献：
  名称：

  Synthesis and preliminary use of novel acrylic ester-derived task-specific ionic liquids

  摘要：

  Novel electrophilic alkenes bearing an ionic liquid-type appendage have been prepared and used in Diels-Alder cycloadditions, 1,4-additions, Heck couplings and Stetter reactions; this new type Of Support allows easy monitoring of the reactions by NMR and MS as well as simple and efficient work-up and isolation procedures. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2003.10.198
• 作为产物：
  描述：

  对羟基苯甲酸甲酯 在 吡啶 、 氢氧化钾 、 氯化亚砜 、 sodium hydride 、 3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 31.0h， 生成 methyl 4-<2-(1H-imidazol-1-yl)-ethoxy>-benzoate
  参考文献：
  名称：

  Synthesis and preliminary use of novel acrylic ester-derived task-specific ionic liquids

  摘要：

  Novel electrophilic alkenes bearing an ionic liquid-type appendage have been prepared and used in Diels-Alder cycloadditions, 1,4-additions, Heck couplings and Stetter reactions; this new type Of Support allows easy monitoring of the reactions by NMR and MS as well as simple and efficient work-up and isolation procedures. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2003.10.198

文献信息

• Biagi; Dell'Omodarme; Ferretti, Il Farmaco, 1990, vol. 45, # 11, p. 1181 - 1192
  作者：Biagi、Dell'Omodarme、Ferretti、Giorgi、Livi、Scartoni

  DOI：——

  日期：——
• US5708171A
  申请人：——

  公开号：US5708171A

  公开（公告）日：1998-01-13
• Synthesis and preliminary use of novel acrylic ester-derived task-specific ionic liquids
  作者：Siddam Anjaiah、Srivari Chandrasekhar、René Grée

  DOI：10.1016/j.tetlet.2003.10.198

  日期：2004.1

  Novel electrophilic alkenes bearing an ionic liquid-type appendage have been prepared and used in Diels-Alder cycloadditions, 1,4-additions, Heck couplings and Stetter reactions; this new type Of Support allows easy monitoring of the reactions by NMR and MS as well as simple and efficient work-up and isolation procedures. (C) 2003 Elsevier Ltd. All rights reserved.