2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-5,6-dihydro-2H-spiro[cyclopenta[c]pyrazole-4,2'-[1,3]dithiolane] | 333995-86-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-5,6-dihydro-2H-spiro[cyclopenta[c]pyrazole-4,2'-[1,3]dithiolane]
• CAS: 333995-86-1
• 化学式: C₁₅H₉Cl₂F₅N₂S₂
• 分子量: 447.28
• InChiKey: QQRPYYLPPRCQKQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.02
• 重原子数：
  26.0
• 可旋转键数：
  1.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  17.82
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-5,6-dihydro-2H-spiro[cyclopenta[c]pyrazole-4,2'-[1,3]dithiolane] 在 N-碘代丁二酰亚胺 作用下， 以 二氯甲烷 为溶剂， 生成 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4,4,5,5-tetrafluoro-2,4,5,6-tetrahydrocyclopenta[c]pyrazole
  参考文献：
  名称：

  Synthesis and insecticidal activity of fluorinated 2-(2,6-dichloro-4-trifluoromethylphenyl)-2,4,5,6-tetrahydrocyclopentapyrazoles

  摘要：

  A number of fluorinated 1-aryl-tetrahydrocyclopentapyrazoles were synthesized and their insecticidal activity was evaluated. Some of the fluorinated compounds had significant insecticidal properties. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.012
• 作为产物：
  描述：

  cis-2-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-2,4,5,6-tetrahydrocyclopenta[c]pyrazole-5,6-diol 在 chromium(VI) oxide 、 二乙胺基三氟化硫 、 三氟化硼乙醚 、 对甲苯磺酸 、 溶剂黄146 作用下， 以 二氯甲烷 、 苯 为溶剂， 反应 0.25h， 生成 2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-5,6-dihydro-2H-spiro[cyclopenta[c]pyrazole-4,2'-[1,3]dithiolane]
  参考文献：
  名称：

  Synthesis and insecticidal activity of fluorinated 2-(2,6-dichloro-4-trifluoromethylphenyl)-2,4,5,6-tetrahydrocyclopentapyrazoles

  摘要：

  A number of fluorinated 1-aryl-tetrahydrocyclopentapyrazoles were synthesized and their insecticidal activity was evaluated. Some of the fluorinated compounds had significant insecticidal properties. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.012