bis(N-phenyltrifluoroacetimidoyl) disulfide | 1225041-11-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: bis(N-phenyltrifluoroacetimidoyl) disulfide
• 英文别名: [N-phenyl-C-(trifluoromethyl)carbonimidoyl]sulfanyl 2,2,2-trifluoro-N-phenylethanimidothioate
• CAS: 1225041-11-1
• 化学式: C₁₆H₁₀F₆N₂S₂
• 分子量: 408.391
• InChiKey: FUJVBJXQMYKCJJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  75.3
• 氢给体数：
  0
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  2,2,2-trifluoro-N-phenylethanethioamide 在 碘苯二乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 0.08h， 以92%的产率得到bis(N-phenyltrifluoroacetimidoyl) disulfide
  参考文献：
  名称：

  Switching reaction pathways of trifluoromethylated thiobenzanilides by choice of different oxidative systems

  摘要：

  Trifluoromethylated thiobenzanilides are efficiently converted to 2-trifluoromethylbenzothiazoles via intramolecular oxidative cyclization under CAN/NaHCO(3) oxidation, while the dimerized products with "-S-S-" bond linkage are obtained when PIDA is used as an oxidant. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2011.02.010

文献信息

• A General and Straightforward Method for the Synthesis of 2-Trifluoromethylbenzothiazoles
  作者：Jiangtao Zhu、Zixian Chen、Haibo Xie、Shan Li、Yongming Wu

  DOI：10.1021/ol1006899

  日期：2010.5.21

  An efficient one-pot method for the synthesis of 2-trifluoromethylbenzothiazoles by the treatment of trifluoromethylimidoyl chlorides with sodium hydrosulfide hydrate using PdCl(2) as the sole catalyst in DMSO is described. The reaction proceeds via thiolation/C H bond functionalization/C S bond formation in moderate to high yields with good functional group tolerance.
• Switching reaction pathways of trifluoromethylated thiobenzanilides by choice of different oxidative systems
  作者：Jiangtao Zhu、Haibo Xie、Shan Li、Zixian Chen、Yongming Wu

  DOI：10.1016/j.jfluchem.2011.02.010

  日期：2011.5

  Trifluoromethylated thiobenzanilides are efficiently converted to 2-trifluoromethylbenzothiazoles via intramolecular oxidative cyclization under CAN/NaHCO(3) oxidation, while the dimerized products with "-S-S-" bond linkage are obtained when PIDA is used as an oxidant. (C) 2011 Elsevier B.V. All rights reserved.