| 1046468-55-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• CAS: 1046468-55-6
• 化学式: C₁₂H₁₄FNO₂S
• 分子量: 255.313
• InChiKey: AFJSRNGWNRJVFA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.84
• 重原子数：
  17.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  21.7
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  在 肼 作用下， 以 二甲基亚砜 为溶剂， 以27%的产率得到5-methoxy-3-(morpholin-4-yl)-1H-indazole
  参考文献：
  名称：

  An efficient route to 3-aminoindazoles and 3-amino-7-azaindazoles

  摘要：

  A non-acidic procedure for the preparation of 3-aminoindazoles and 3-amino-7-azaindazoles from 2-fluoroaryl carboxylic acids is reported. The synthesis starts from readily available starting materials and uses mild and practical reaction conditions in a three-step overall procedure. Products were isolated for a number of examples, but yields varied significantly depending on electronic nature of the substituents. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.05.100
• 作为产物：
  描述：

  (2-Fluoro-5-methoxyphenyl)(morpholino)methanone 在 劳森试剂 作用下， 以 甲苯 为溶剂， 生成
  参考文献：
  名称：

  An efficient route to 3-aminoindazoles and 3-amino-7-azaindazoles

  摘要：

  A non-acidic procedure for the preparation of 3-aminoindazoles and 3-amino-7-azaindazoles from 2-fluoroaryl carboxylic acids is reported. The synthesis starts from readily available starting materials and uses mild and practical reaction conditions in a three-step overall procedure. Products were isolated for a number of examples, but yields varied significantly depending on electronic nature of the substituents. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.05.100