4-methyl-5-(1-phenylethyl)thiazole

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 4-methyl-5-(1-phenylethyl)thiazole
• 英文别名: 4-Methyl-5-(1-phenylethyl)-1,3-thiazole
• 化学式: C₁₂H₁₃NS
• 分子量: 203.308
• InChiKey: BHRHVMRIKBULLG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  41.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4-甲基-5-乙烯基噻唑 、 苯 在 三氟甲磺酸 作用下， 反应 3.0h， 以92%的产率得到4-methyl-5-(1-phenylethyl)thiazole
  参考文献：
  名称：

  Dicationic Electrophiles from Olefinic Amines in Superacid

  摘要：

  This paper describes the superacid-catalyzed chemistry of olefinic amines and related compounds. A variety of olefinic amines are found to react with benzene in CF3SO3H (triflic acid) to give addition products in good yields (75-99%), including the pharmaceutical agents fenpiprane and prozapine. A general mechanism is proposed that invokes the formation of reactive, dicationic electrophiles and the direct observation of a diprotonated species is reported from low-temperature NMR experiments. This chemistry is also used to conveniently prepare functionalized polystyrene beads having pendant amine groups.

  DOI：

  10.1021/jo030024z