methyl (E)-6-(1,3-oxazol-5-yl)hex-2-enoate | 354149-89-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: methyl (E)-6-(1,3-oxazol-5-yl)hex-2-enoate
• CAS: 354149-89-6
• 化学式: C₁₀H₁₃NO₃
• 分子量: 195.218
• InChiKey: JBIPDQJXJCFSEH-GQCTYLIASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  52.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  三氟甲烷磺酸甲酯 、 methyl (E)-6-(1,3-oxazol-5-yl)hex-2-enoate 以 氯仿 为溶剂， 反应 0.08h， 生成
  参考文献：
  名称：

  N-Methylated 5-Alkenyloxazolium Salt Transformations

  摘要：

  [GRAPHICS]In the course of natural product synthetic studies, 5-(4-pentenyl)oxazole and 5-(5-hexenyl)oxazole were N-methylated. The initial N-methylated 5-alkenyloxazolium salt adducts were found to be only intermediates and were ultimately transformed into hydroindole and hydroisoquinoline compounds, respectively.

  DOI：

  10.1021/ol016088i
• 作为产物：
  描述：

  5-(4,4-Dimethoxy-butyl)-oxazole 在 oxonium 作用下， 生成 methyl (E)-6-(1,3-oxazol-5-yl)hex-2-enoate
  参考文献：
  名称：

  N-Methylated 5-Alkenyloxazolium Salt Transformations

  摘要：

  [GRAPHICS]In the course of natural product synthetic studies, 5-(4-pentenyl)oxazole and 5-(5-hexenyl)oxazole were N-methylated. The initial N-methylated 5-alkenyloxazolium salt adducts were found to be only intermediates and were ultimately transformed into hydroindole and hydroisoquinoline compounds, respectively.

  DOI：

  10.1021/ol016088i