[3-(Hydroxymethyl)pyridin-4-yl]-(2-methoxyphenyl)methanone | 156638-80-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [3-(Hydroxymethyl)pyridin-4-yl]-(2-methoxyphenyl)methanone
• CAS: 156638-80-1
• 化学式: C₁₄H₁₃NO₃
• 分子量: 243.262
• InChiKey: BDFFMQHGVGSOEX-UHFFFAOYSA-N

物化性质

• 沸点：
  475.0±45.0 °C(predicted)
• 密度：
  1.224±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  59.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [3-(Hydroxymethyl)pyridin-4-yl]-(2-methoxyphenyl)methanone 在 potassium permanganate 作用下， 以 水 、 丙酮 为溶剂， 反应 1.0h， 生成 4-(2-甲氧基苯甲酰基)烟酸
  参考文献：
  名称：

  Application of Organolithium and Related Reagents in Synthesis. XV. A Concise Regiospecific Conversion of Picolinic- and Isonicotinic Acids into 2-Benzoyl- and 4-Benzoylnicotinic Acids

  摘要：

  The synthesis of the azaphthalides (7) and (8) and their conversion into the corresponding 2- and 4-benzoyl-3-hydroxymethylpyridines (9) and (10), very useful precursors of the 2- and 4-benzoylated nicotinic acids (11) and (12), as a way of regiospecific transformation of the picolin- and isonicotinanilides (1) and (2) into nicotinic acid derivatives, is described.

  DOI：

  10.1080/00397919408010186
• 作为产物：
  描述：

  异烟酰苯胺 在 盐酸 、 正丁基锂 、 钾硼氢 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 75.6h， 生成 [3-(Hydroxymethyl)pyridin-4-yl]-(2-methoxyphenyl)methanone
  参考文献：
  名称：

  Application of Organolithium and Related Reagents in Synthesis. XV. A Concise Regiospecific Conversion of Picolinic- and Isonicotinic Acids into 2-Benzoyl- and 4-Benzoylnicotinic Acids

  摘要：

  The synthesis of the azaphthalides (7) and (8) and their conversion into the corresponding 2- and 4-benzoyl-3-hydroxymethylpyridines (9) and (10), very useful precursors of the 2- and 4-benzoylated nicotinic acids (11) and (12), as a way of regiospecific transformation of the picolin- and isonicotinanilides (1) and (2) into nicotinic acid derivatives, is described.

  DOI：

  10.1080/00397919408010186

文献信息

• Application of Organolithium and Related Reagents in Synthesis. XV. A Concise Regiospecific Conversion of Picolinic- and Isonicotinic Acids into 2-Benzoyl- and 4-Benzoylnicotinic Acids
  作者：J. Epsztajn、A. Jóźwiak、A. K. Szcześniak

  DOI：10.1080/00397919408010186

  日期：1994.7

  The synthesis of the azaphthalides (7) and (8) and their conversion into the corresponding 2- and 4-benzoyl-3-hydroxymethylpyridines (9) and (10), very useful precursors of the 2- and 4-benzoylated nicotinic acids (11) and (12), as a way of regiospecific transformation of the picolin- and isonicotinanilides (1) and (2) into nicotinic acid derivatives, is described.