3-methyl-5-phenyl oxazolidine-2-thione

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-methyl-5-phenyl oxazolidine-2-thione
• 英文别名: 3-Methyl-5-phenyl-1,3-oxazolidine-2-thione
• 化学式: C₁₀H₁₁NOS
• 分子量: 193.269
• InChiKey: AIYDWCFBDSHKBW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  44.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  苯甲醛 、 1,3-dithiolan-2-ylidene-methyl-(trimethylsilylmethyl)ammonium 在 silica gel 、 cesium fluoride 作用下， 生成 3-methyl-5-phenyl oxazolidine-2-thione 、 9-phenyl-6-methyl 1,4-dithia-6-aza-8-oxaspiro<4,4>nonane
  参考文献：
  名称：

  Hetero-1,3-dipolar cycloadditions of dithiolane-isocyanate imminium methylides: A novel route to 1,3-oxazolidine- and thiazolidine-2-thiones

  摘要：

  Dithiolane- isocyanate imminium methylides which are a new type of azomethine methylide-derived 1,3-dipole undergo efficient and regioselective cycloaddition to conjugated carbonyls and thiocarbonyls to yield predominantly 1,3-oxazolidine- and thiazolidine-2-thiones formed from the initial cycloadducts via loss of thurane.

  DOI：

  10.1016/0040-4039(95)02249-x

文献信息

• Hetero-1,3-dipolar cycloadditions of dithiolane-isocyanate imminium methylides: A novel route to 1,3-oxazolidine- and thiazolidine-2-thiones
  作者：Colin W.G. Fishwick、Richard J. Foster、Robin E. Carr

  DOI：10.1016/0040-4039(95)02249-x

  日期：1996.1

  Dithiolane- isocyanate imminium methylides which are a new type of azomethine methylide-derived 1,3-dipole undergo efficient and regioselective cycloaddition to conjugated carbonyls and thiocarbonyls to yield predominantly 1,3-oxazolidine- and thiazolidine-2-thiones formed from the initial cycloadducts via loss of thurane.