3-Pyridin-2-ylsulfanylcyclohexan-1-one | 153054-46-7

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 3-Pyridin-2-ylsulfanylcyclohexan-1-one
• CAS: 153054-46-7；901129-76-8
• 化学式: C₁₁H₁₃NOS
• 分子量: 207.296
• InChiKey: RJEWIOKZKYUAPH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  55.3
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-巯基吡啶 、 2-环己烯-1-酮 在 C₃₃H₄₃FeN₄O₂S 作用下， 以 正戊烷 为溶剂， 反应 18.0h， 以96%的产率得到3-Pyridin-2-ylsulfanylcyclohexan-1-one
  参考文献：
  名称：

  Mild Hydrosulfenylation of Olefins under Neutral Conditions Using a Defined NHC-Ligated Iron–Sulfur Catalyst

  摘要：

  A defined NHC-Fe-S complex proved to be an efficient catalyst for the selective hydrosulfenylation of alpha/beta-unsaturated ketones or vinylnitriles. A wide range of different aliphatic thiols were transferred in this atom-economic reaction into the corresponding thioethers. Mild reaction conditions, equimolar amounts of substrates, low catalyst loadings, and mild reaction conditions are characteristic for this transformation.

  DOI：

  10.1021/cs4009336

文献信息

• Mild Hydrosulfenylation of Olefins under Neutral Conditions Using a Defined NHC-Ligated Iron–Sulfur Catalyst
  作者：Isabel Alt、Philipp Rohse、Bernd Plietker

  DOI：10.1021/cs4009336

  日期：2013.12.6

  A defined NHC-Fe-S complex proved to be an efficient catalyst for the selective hydrosulfenylation of alpha/beta-unsaturated ketones or vinylnitriles. A wide range of different aliphatic thiols were transferred in this atom-economic reaction into the corresponding thioethers. Mild reaction conditions, equimolar amounts of substrates, low catalyst loadings, and mild reaction conditions are characteristic for this transformation.