but-2-ynyl 4-fluorophenyl sulfide

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: but-2-ynyl 4-fluorophenyl sulfide
• 英文别名: 1-But-2-ynylsulfanyl-4-fluorobenzene
• 化学式: C₁₀H₉FS
• 分子量: 180.246
• InChiKey: UKQYZAHVTPCWRX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  25.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  对氟苯硫酚 、 3-methylethynyl methyl carbonate 在 N-甲基哌啶 、 (cyclooctadienyl)(cyclopentadienyl)ruthenium chloride 作用下， 反应 3.0h， 以71%的产率得到but-2-ynyl 4-fluorophenyl sulfide
  参考文献：
  名称：

  Ruthenium-Catalyzed S-Propargylation of Thiols Enables the Rapid Synthesis of Propargylic Sulfides

  摘要：

  A new and highly efficient catalytic system based on CpRuClL2 is proposed for the S-propargylation of thiols by propargylic carbonates under neutral conditions, in which specific requirements inherent to the different reactivities of aliphatic and aromatic thiols are achieved by tuning both the nature of the ancillary ligand L and the experimental conditions.

  DOI：

  10.1021/ja027750o

文献信息

• Ruthenium-Catalyzed <i>S</i>-Propargylation of Thiols Enables the Rapid Synthesis of Propargylic Sulfides
  作者：Teruyuki Kondo、Yusuke Kanda、Atsushi Baba、Kenji Fukuda、Ayako Nakamura、Kenji Wada、Yasuhiro Morisaki、Take-aki Mitsudo

  DOI：10.1021/ja027750o

  日期：2002.11.1

  A new and highly efficient catalytic system based on CpRuClL2 is proposed for the S-propargylation of thiols by propargylic carbonates under neutral conditions, in which specific requirements inherent to the different reactivities of aliphatic and aromatic thiols are achieved by tuning both the nature of the ancillary ligand L and the experimental conditions.