2-cyclohexyl-6-methylsulfanyl-1H-benzimidazole | 1011232-00-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 2-cyclohexyl-6-methylsulfanyl-1H-benzimidazole
• CAS: 1011232-00-0
• 化学式: C₁₄H₁₈N₂S
• 分子量: 246.376
• InChiKey: NEWHICCZOJRNAK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  54
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  N-hydroxy-N'-(4-methylsulfanylphenyl)cyclohexanecarboximidamide 在 TEA 、 4-甲苯磺酸酐 作用下， 以 氯仿 为溶剂， 反应 1.0h， 以98%的产率得到2-cyclohexyl-6-methylsulfanyl-1H-benzimidazole
  参考文献：
  名称：

  N-芳基a胺肟甲苯磺酸化合成取代的苯并咪唑

  摘要：

  的甲苯磺酰化ñ -芳基中TEA的存在偕胺肟产生高收率的相应的苯并咪唑类。

  DOI：

  10.1016/j.tetlet.2007.11.157

文献信息

• Synthesis of α-Chloroaldoxime <i>O</i>-Methanesulfonates and Their Use in the Synthesis of Functionalized Benzimidazoles
  作者：Yuhei Yamamoto、Hiroo Mizuno、Takayuki Tsuritani、Toshiaki Mase

  DOI：10.1021/jo8023544

  日期：2009.2.6

  Three different alpha-chloroaldoxime O-methanesulfonates were synthesized to investigate their chemical properties. The compounds were found to be stable and were able to be stored at ambient temperature without any precautions. The reactions with anilines were investigated, and it was found that an additive is required to activate the sulfonate. TMEDA was found to be the most efficient additive, and various benzimidazoles were synthesized through the reaction.
• Synthesis of substituted benzimidazoles via tosylation of N-aryl amidoxime
  作者：Yuhei Yamamoto、Takayuki Tsuritani、Toshiaki Mase

  DOI：10.1016/j.tetlet.2007.11.157

  日期：2008.1

  Tosylation of N-aryl amidoxime in the presence of TEA produces the corresponding benzimidazoles in high yields.

  的甲苯磺酰化ñ -芳基中TEA的存在偕胺肟产生高收率的相应的苯并咪唑类。