2-(2-propylphenoxy)propionic acid methyl ester | 1197813-09-4

• 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: 2-(2-propylphenoxy)propionic acid methyl ester
• 英文别名: Methyl 2-(2-propylphenoxy)propanoate
• CAS: 1197813-09-4
• 化学式: C₁₃H₁₈O₃
• 分子量: 222.284
• InChiKey: UUKZYXQZPHWUCT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  16
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(2-propylphenoxy)propionic acid methyl ester 、 乙二胺 在 三甲基铝 作用下， 以 甲苯 为溶剂， 以65%的产率得到2-[1-(2-propylphenoxy)ethyl]-4,5-dihydro-1H-imidazole
  参考文献：
  名称：

  Might Adrenergic α_2C-Agonists/α_2A-Antagonists Become Novel Therapeutic Tools for Pain Treatment with Morphine?

  摘要：

  The imidazoline nucleus linked in position 2 via an oxyethylene bridge to a phenyl ring carrying an ortho substituent of moderate steric bulk provided alpha(2)-adrenergic (AR) ligands endowed with significant alpha(2C)-agonism/alpha(2A)-antagonism. Similar behavior was displayed by cirazoline (12). For their positive morphine analgesia modulation (due to alpha(2C)-AR stimulation) and sedation overcoming (due to alpha(2A)-AR antagonism), 8 and 11 might be useful as adjuvant agents in the management of pain with morphine.

  DOI：

  10.1021/jm901262f
• 作为产物：
  描述：

  2-正丙基苯酚 、 2-溴丙酸甲酯 在 potassium carbonate 作用下， 以 乙二醇二甲醚 为溶剂， 反应 8.0h， 以59%的产率得到2-(2-propylphenoxy)propionic acid methyl ester
  参考文献：
  名称：

  Might Adrenergic α_2C-Agonists/α_2A-Antagonists Become Novel Therapeutic Tools for Pain Treatment with Morphine?

  摘要：

  The imidazoline nucleus linked in position 2 via an oxyethylene bridge to a phenyl ring carrying an ortho substituent of moderate steric bulk provided alpha(2)-adrenergic (AR) ligands endowed with significant alpha(2C)-agonism/alpha(2A)-antagonism. Similar behavior was displayed by cirazoline (12). For their positive morphine analgesia modulation (due to alpha(2C)-AR stimulation) and sedation overcoming (due to alpha(2A)-AR antagonism), 8 and 11 might be useful as adjuvant agents in the management of pain with morphine.

  DOI：

  10.1021/jm901262f

文献信息

• Might Adrenergic α_2C-Agonists/α_2A-Antagonists Become Novel Therapeutic Tools for Pain Treatment with Morphine?
  作者：Claudia Cardinaletti、Laura Mattioli、Francesca Ghelfi、Fabio Del Bello、Mario Giannella、Ariana Bruzzone、Hervé Paris、Marina Perfumi、Alessandro Piergentili、Wilma Quaglia、Maria Pigini

  DOI：10.1021/jm901262f

  日期：2009.11.26

  The imidazoline nucleus linked in position 2 via an oxyethylene bridge to a phenyl ring carrying an ortho substituent of moderate steric bulk provided alpha(2)-adrenergic (AR) ligands endowed with significant alpha(2C)-agonism/alpha(2A)-antagonism. Similar behavior was displayed by cirazoline (12). For their positive morphine analgesia modulation (due to alpha(2C)-AR stimulation) and sedation overcoming (due to alpha(2A)-AR antagonism), 8 and 11 might be useful as adjuvant agents in the management of pain with morphine.