ethyl [2-(N,N-dimethylamino)phenyl]acetate | 1616786-41-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: ethyl [2-(N,N-dimethylamino)phenyl]acetate
• 英文别名: Ethyl 2-[2-(dimethylamino)phenyl]acetate
• CAS: 1616786-41-4
• 化学式: C₁₂H₁₇NO₂
• 分子量: 207.272
• InChiKey: DEXLIQXPMYDVQH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  29.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  N,N-二甲基苯胺 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 反应 13.25h， 生成 ethyl [2-(N,N-dimethylamino)phenyl]acetate
  参考文献：
  名称：

  Metal-Free Functionalization of N,N-Dialkylanilines via Temporary Oxidation to N,N-Dialkylaniline N-Oxides and Group Transfer

  摘要：

  A simple set of protocols for the controlled elaboration of anilines is reported allowing access to a diverse array of aminophenols, aminoarylsulfonates, alkylated anilines, and aminoanilines in 29-95% yield in a single laboratory operation from easily isolable, bench-stable N,N-dialkylaniline N-oxides. The introduction of new C-O, C-C, and C-N bonds on the aromatic ring is made possible by a temporary increase in oxidation level and excision of a weak N-O bond.

  DOI：

  10.1021/ol501813s

文献信息

• [EN] COMPOUNDS FOR THE REDUCTION OF ß-AMYLOID PRODUCTION<br/>[FR] COMPOSÉS POUR LA RÉDUCTION DE LA PRODUCTION DE ß-AMYLOÏDE
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2012103297A1

  公开（公告）日：2012-08-02

  The present disclosure provides a series of compounds of the formula (I), which modulate β-amyloid peptide (β-ΑΡ) production and are useful in the treatment of Alzheimer's Disease and other conditions affected by β-amyloid peptide (β-ΑΡ) production.

  本公开提供了一系列化合物的公式(I)，这些化合物调节β-淀粉样肽(β-ΑΡ)的产生，并且在治疗阿尔茨海默病和其他受β-淀粉样肽(β-ΑΡ)产生影响的疾病中有用。
• COMPOUNDS FOR THE REDUCTION OF ß-AMYLOID PRODUCTION
  申请人：Bristol-Myers Squibb Company

  公开号：EP2668168A1

  公开（公告）日：2013-12-04
• Metal-Free Functionalization of <i>N</i>,<i>N</i>-Dialkylanilines via Temporary Oxidation to <i>N</i>,<i>N</i>-Dialkylaniline <i>N</i>-Oxides and Group Transfer
  作者：Robert S. Lewis、Michael F. Wisthoff、J. Grissmerson、William J. Chain

  DOI：10.1021/ol501813s

  日期：2014.7.18

  A simple set of protocols for the controlled elaboration of anilines is reported allowing access to a diverse array of aminophenols, aminoarylsulfonates, alkylated anilines, and aminoanilines in 29-95% yield in a single laboratory operation from easily isolable, bench-stable N,N-dialkylaniline N-oxides. The introduction of new C-O, C-C, and C-N bonds on the aromatic ring is made possible by a temporary increase in oxidation level and excision of a weak N-O bond.