4-[Cyclopentylidene-[4-(methoxymethoxy)phenyl]methyl]phenol | 1242078-16-5

• 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-[Cyclopentylidene-[4-(methoxymethoxy)phenyl]methyl]phenol
• CAS: 1242078-16-5
• 化学式: C₂₀H₂₂O₃
• 分子量: 310.393
• InChiKey: GEAGJBQKQFOPPP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-[Cyclopentylidene-[4-(methoxymethoxy)phenyl]methyl]phenol 、 对甲苯磺酸氟乙酯 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 反应 1.0h， 以93.3%的产率得到C₂₂H₂₅FO₃
  参考文献：
  名称：

  Practical Synthesis of FEt-penta-cyclofenil and Its Derivatives for Potential PET Imaging

  摘要：

  Generally, FEt-penta-cyclofenil and its derivatives have greater relative binding affinity to estradiol receptors than estradiol. (4-Fluoroethoxyphenyl)-(4'-hydroxyphenyl) methylenecyclopentane and its derivatives were synthesized for potential radioactive image agents, and their structures were characterized by ultraviolet, infrared, 1H NMR, 19F NMR, and high-resolution mass spectrometry.

  DOI：

  10.1080/00397910903419829
• 作为产物：
  描述：

  1,1-bis(4-hydroxyphenyl)methylenecyclopentane 、 氯甲基甲基醚 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 反应 2.0h， 以37.3%的产率得到4-[Cyclopentylidene-[4-(methoxymethoxy)phenyl]methyl]phenol
  参考文献：
  名称：

  Practical Synthesis of FEt-penta-cyclofenil and Its Derivatives for Potential PET Imaging

  摘要：

  Generally, FEt-penta-cyclofenil and its derivatives have greater relative binding affinity to estradiol receptors than estradiol. (4-Fluoroethoxyphenyl)-(4'-hydroxyphenyl) methylenecyclopentane and its derivatives were synthesized for potential radioactive image agents, and their structures were characterized by ultraviolet, infrared, 1H NMR, 19F NMR, and high-resolution mass spectrometry.

  DOI：

  10.1080/00397910903419829

文献信息

• Practical Synthesis of FEt-penta-cyclofenil and Its Derivatives for Potential PET Imaging
  作者：Hua Zhu、Liliang Huang、Xiaoping Xu、Yu-Mei Shen

  DOI：10.1080/00397910903419829

  日期：2010.10.20

  Generally, FEt-penta-cyclofenil and its derivatives have greater relative binding affinity to estradiol receptors than estradiol. (4-Fluoroethoxyphenyl)-(4'-hydroxyphenyl) methylenecyclopentane and its derivatives were synthesized for potential radioactive image agents, and their structures were characterized by ultraviolet, infrared, 1H NMR, 19F NMR, and high-resolution mass spectrometry.