3-endo-[2-cyclopropylmethoxy-4-(trifluoromethyl)phenoxy]-8-[5-(trifluoromethyl)-2-pyridyloxy]-8-azabicyclo[3.2.1]octane | 1313289-99-4

• 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: 3-endo-[2-cyclopropylmethoxy-4-(trifluoromethyl)phenoxy]-8-[5-(trifluoromethyl)-2-pyridyloxy]-8-azabicyclo[3.2.1]octane
• CAS: 1313289-99-4
• 化学式: C₂₄H₂₄F₆N₂O₃
• 分子量: 502.457
• InChiKey: SSQYHVWKDMFDCT-BWTSREIZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.28
• 重原子数：
  35.0
• 可旋转键数：
  7.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  43.82
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  3-endo-[2-cyclopropylmethoxy-4-(trifluoromethyl)phenoxy]-8-azabicyclo[3.2.1]octane 在 sodium hydride 、 potassium carbonate 、 间氯过氧苯甲酸 、 potassium iodide 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 、 mineral oil 为溶剂， 反应 4.67h， 生成 3-endo-[2-cyclopropylmethoxy-4-(trifluoromethyl)phenoxy]-8-[5-(trifluoromethyl)-2-pyridyloxy]-8-azabicyclo[3.2.1]octane
  参考文献：
  名称：

  EP2518069

  摘要：

  公开号：

文献信息

• CYCLIC AMINE COMPOUND AND ACARICIDE
  申请人：Hamamoto Isami

  公开号：US20120289700A1

  公开（公告）日：2012-11-15

  Provided is a cyclic amine compound, represented by the following formula (I) that has superior acaricidal activity, has superior properties and safety, and which can be synthesized industrially advantageously, a salt thereof and an acaricide: (wherein, Cy 1 and Cy 2 respectively and independently represent, for example, an aryl group, R 1a , R 1b , R 2a , R 2b , R 3a , R 3b , R 4a , R 4b and R 5a respectively and independently represent, for example, a hydrogen atom, R 1a and R 2a or R 3a and R 4a may together form, for example, an ethylene group, R 10 , R 11 , R 20 and R 21 respectively and independently represent, for example, an alkyl group, R 10 or R 11 may respectively or mutually, or together with an atom that bonds on Cy 1 , form a ring, R 20 or R 21 on Cy 2 may respectively or mutually, or with an atom that bonds on Cy 2 , form a ring, m represents an integer of 0 to 5, n represents an integer of 0 to 5, p represents an integer of 0 to 5, and r represents an integer of 0 to 5).
• US8993592B2
  申请人：——

  公开号：US8993592B2

  公开（公告）日：2015-03-31
• EP2518069
  申请人：——

  公开号：——

  公开（公告）日：——