1-(Bis-phenylsulfanyl-methyl)-2-(3-methyl-but-3-enyloxy)-benzene | 295785-51-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1-(Bis-phenylsulfanyl-methyl)-2-(3-methyl-but-3-enyloxy)-benzene
• 英文别名: 1-[Bis(phenylsulfanyl)methyl]-2-(3-methylbut-3-enoxy)benzene；1-[bis(phenylsulfanyl)methyl]-2-(3-methylbut-3-enoxy)benzene
• CAS: 295785-51-2
• 化学式: C₂₄H₂₄OS₂
• 分子量: 392.586
• InChiKey: DOVRMJBNFZDOKN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8
• 重原子数：
  27
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  59.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(Bis-phenylsulfanyl-methyl)-2-(3-methyl-but-3-enyloxy)-benzene 在 Cp2Ti(P(OEt)3)2 作用下， 以 四氢呋喃 为溶剂， 以71%的产率得到4-methyl-2,3-dihydro-1-benzoxepin
  参考文献：
  名称：

  Ring-Closing Metathesis of Titanium–Carbene Complexes Prepared from Thioacetals Having a Carbon–Carbon Double Bond

  摘要：

  The ring-closing metathesis proceeded to give cycloalkenes in good yields when diphenyl thioacetals having a carbon-carbon double bond were treated with the low-valent titanium species Cp2Ti[P(OEt)(3)](2) in THF at room temperature and then at reflux. This methodology is successfully applied to the preparation of cyclic ethers and sulfides. (C) 2000 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(00)00201-5
• 作为产物：
  描述：

  3-甲基-3-丁烯-1-醇 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 反应 20.0h， 生成 1-(Bis-phenylsulfanyl-methyl)-2-(3-methyl-but-3-enyloxy)-benzene
  参考文献：
  名称：

  Ring-Closing Metathesis of Titanium–Carbene Complexes Prepared from Thioacetals Having a Carbon–Carbon Double Bond

  摘要：

  The ring-closing metathesis proceeded to give cycloalkenes in good yields when diphenyl thioacetals having a carbon-carbon double bond were treated with the low-valent titanium species Cp2Ti[P(OEt)(3)](2) in THF at room temperature and then at reflux. This methodology is successfully applied to the preparation of cyclic ethers and sulfides. (C) 2000 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(00)00201-5

文献信息

• Ring-Closing Metathesis of Titanium–Carbene Complexes Prepared from Thioacetals Having a Carbon–Carbon Double Bond
  作者：Tooru Fujiwara、Yoshiko Kato、Takeshi Takeda

  DOI：10.1016/s0040-4020(00)00201-5

  日期：2000.7

  The ring-closing metathesis proceeded to give cycloalkenes in good yields when diphenyl thioacetals having a carbon-carbon double bond were treated with the low-valent titanium species Cp2Ti[P(OEt)(3)](2) in THF at room temperature and then at reflux. This methodology is successfully applied to the preparation of cyclic ethers and sulfides. (C) 2000 Published by Elsevier Science Ltd.