4-((3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)-phenoxy)methyl)aniline | 1278547-54-8

• 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: 4-((3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)-phenoxy)methyl)aniline
• CAS: 1278547-54-8
• 化学式: C₁₅H₁₁Cl₂F₄NO₂
• 分子量: 384.157
• InChiKey: XJCUOSXNUQYQLK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.39
• 重原子数：
  24.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  44.48
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  4-((3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)-phenoxy)methyl)aniline 、 2,6-二氟苯甲酰异氰酸酯 以 二氯甲烷 为溶剂， 以72.5%的产率得到N-(4-((3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenoxy)methyl)phenylcarbamoyl)-2,6-difluorobenzamide
  参考文献：
  名称：

  Design and Synthesis of Benzoylphenylureas with Fluorinated Substituents on the Aniline Ring as Insect Growth Regulators

  摘要：

  Enormous numbers of synthetic fluorine-containing compounds have been widely used in a variety of fields, especially in drug and pesticide design. To find novel insect growth regulators, a series of benzoylphenylureas with fluorinated substituents were designed and synthesized. The results of larvicidal activities of those novel fluoro-substituted benzoylphenylureas against oriental armyworm and mosquito revealed that most compounds exhibited excellent activities. It is worth mentioning that compounds 3 and 6 exhibited higher activities against oriental armyworm and mosquito than commercial Hexaflumuron. It can be further seen that the insecticidal activities would increase significantly by introducing fluorinated substituents into the structure of the designed benzoylphenylureas.

  DOI：

  10.1021/jf104578j
• 作为产物：
  描述：

  对硝基溴化苄 在 铜 、 氯化铵 、 sodium hydroxide 、 锌 作用下， 以 乙醚 、 乙醇 、 水 为溶剂， 反应 6.0h， 生成 4-((3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)-phenoxy)methyl)aniline
  参考文献：
  名称：

  Design and Synthesis of Benzoylphenylureas with Fluorinated Substituents on the Aniline Ring as Insect Growth Regulators

  摘要：

  Enormous numbers of synthetic fluorine-containing compounds have been widely used in a variety of fields, especially in drug and pesticide design. To find novel insect growth regulators, a series of benzoylphenylureas with fluorinated substituents were designed and synthesized. The results of larvicidal activities of those novel fluoro-substituted benzoylphenylureas against oriental armyworm and mosquito revealed that most compounds exhibited excellent activities. It is worth mentioning that compounds 3 and 6 exhibited higher activities against oriental armyworm and mosquito than commercial Hexaflumuron. It can be further seen that the insecticidal activities would increase significantly by introducing fluorinated substituents into the structure of the designed benzoylphenylureas.

  DOI：

  10.1021/jf104578j