1-hexylsulfanyl-propene | 90728-07-7

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 1-hexylsulfanyl-propene
• 英文别名: hexyl-propenyl sulfide；Hexyl-propenyl-sulfid；1-[(E)-prop-1-enyl]sulfanylhexane
• CAS: 90728-07-7
• 化学式: C₉H₁₈S
• 分子量: 158.308
• InChiKey: PTGDMPRIJPEBGW-XBXARRHUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  10
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  25.3
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-(烯丙基硫基)己烷 、 1-hexylsulfanyl-propene 在 palladium on activated charcoal 、 乙醇 作用下， 生成 hexyl-propyl sulfide
  参考文献：
  名称：

  The Isomerization by Base of Alkyl Allyl Sulfides to Alkyl Propenyl Sulfides. The Mechanism of the Reaction¹

  摘要：

  DOI：

  10.1021/ja01591a063
• 作为产物：
  描述：

  n-hexyl(vinyl)sulfide 在 ruthenium(IV) oxide 乙醇 、 氢气 、 sodium 作用下， 以 甲醇 为溶剂， 25.0~60.0 ℃ 、810.6 kPa 条件下， 反应 96.0h， 生成 1-hexylsulfanyl-propene
  参考文献：
  名称：

  Low Pressure Hydrogenation of Unsaturated Sulphides with Homogeneous and Heterogeneous Ruthenium Catalysts

  摘要：

  Ru2O . nH(2)O and [Ru3O(AcO)(6)(H2O)(3)](AcO-)-Ac-+ were examined for catalytic activity in the hydrogenation of a series of unsaturated sulphides under heterogeneous and homogeneous conditions, respectively. By the appropriate combination of these two methodologies, a number of saturated sulphides could be synthesized in satisfactory to good yields, thus minimizing side reactions.

  DOI：

  10.1080/00397919608003694

文献信息

• The Base-catalyzed Isomerization of Allyl to Propenyl Sulfides
  作者：Charles C. Price、William H. Snyder

  DOI：10.1021/jo01059a505

  日期：1962.12
• The Isomerization by Base of Alkyl Allyl Sulfides to Alkyl Propenyl Sulfides. The Mechanism of the Reaction¹
  作者：D. S. Tarbell、William E. Lovett

  DOI：10.1021/ja01591a063

  日期：1956.5
• Low Pressure Hydrogenation of Unsaturated Sulphides with Homogeneous and Heterogeneous Ruthenium Catalysts
  作者：Vanda Cerè、Franco Massaccesi、Salvatore Pollicino、Alfredo Ricci

  DOI：10.1080/00397919608003694

  日期：1996.3

  Ru2O . nH(2)O and [Ru3O(AcO)(6)(H2O)(3)](AcO-)-Ac-+ were examined for catalytic activity in the hydrogenation of a series of unsaturated sulphides under heterogeneous and homogeneous conditions, respectively. By the appropriate combination of these two methodologies, a number of saturated sulphides could be synthesized in satisfactory to good yields, thus minimizing side reactions.