methyl 4-hydroxy-6-isopropylpyridazine-3-carboxylate | 1414868-35-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: methyl 4-hydroxy-6-isopropylpyridazine-3-carboxylate
• 英文别名: Methyl 4-hydroxy-6-isopropylpyridazine-3-carboxylate；methyl 4-oxo-6-propan-2-yl-1H-pyridazine-3-carboxylate
• CAS: 1414868-35-1
• 化学式: C₉H₁₂N₂O₃
• 分子量: 196.206
• InChiKey: RYXGLTPPAPBALA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  67.8
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  5-hydroxy-6-methyl-3-oxo-heptanoic acid methyl ester 在 4-乙酰氨基苯磺酰叠氮 、 三乙胺 、 三(二甲胺基)膦 、 2-碘酰基苯甲酸 作用下， 以 二氯甲烷 、 乙腈 为溶剂， 反应 20.0h， 生成 methyl 4-hydroxy-6-isopropylpyridazine-3-carboxylate
  参考文献：
  名称：

  A short and convenient strategy for the synthesis of pyridazines via Diaza–Wittig reaction

  摘要：

  A convenient and selective synthesis of 6-substituted-4-hydroxy-3-methoxycarbonyl pyridazines has been developed via a diaza-Wittig reaction. The desired products substituted at the C6 position can be obtained from readily available starting materials under mild conditions. This represents an attractive new method for the synthesis of pyridazine derivatives. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.09.059

文献信息

• A short and convenient strategy for the synthesis of pyridazines via Diaza–Wittig reaction
  作者：Hassen Bel Abed、Oscar Mammoliti、Guy Van Lommen、Piet Herdewijn

  DOI：10.1016/j.tetlet.2012.09.059

  日期：2012.11

  A convenient and selective synthesis of 6-substituted-4-hydroxy-3-methoxycarbonyl pyridazines has been developed via a diaza-Wittig reaction. The desired products substituted at the C6 position can be obtained from readily available starting materials under mild conditions. This represents an attractive new method for the synthesis of pyridazine derivatives. (C) 2012 Elsevier Ltd. All rights reserved.