2-[2,3-Dichloro-4-(1,1-dicyanoprop-1-en-2-yl)phenoxy]acetic acid | 29360-58-5

• 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: 2-[2,3-Dichloro-4-(1,1-dicyanoprop-1-en-2-yl)phenoxy]acetic acid
• CAS: 29360-58-5
• 化学式: C₁₃H₈Cl₂N₂O₃
• 分子量: 311.124
• InChiKey: OLEKQJHSDXFMQC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  94.1
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2,3-二氯茴香醚 在 ammonium acetate 作用下， 以 苯 为溶剂， 生成 2-[2,3-Dichloro-4-(1,1-dicyanoprop-1-en-2-yl)phenoxy]acetic acid
  参考文献：
  名称：

  (Vinylaryloxy)acetic acids. A new class of diuretic agents. 4. Various [(2-substituted and 2,2-disubstituted vinyl)aryloxy]acetic acids

  摘要：

  A variety of [(2-substituted and 2,2-disubstituted vinyl)aryloxy]acetic acids was synthesized in which the substituents were primarily electron-withdrawing groups. These compounds were tested in dogs for their saluretic and diuretic properties. Many of the compounds exhibited significant activity; however, they were generally less potent than those reported in the three earlier papers in this series.

  DOI：

  10.1021/jm00229a024

文献信息

• (Vinylaryloxy)acetic acids. A new class of diuretic agents. 4. Various [(2-substituted and 2,2-disubstituted vinyl)aryloxy]acetic acids
  作者：Otto W. Woltersdorf、Charles M. Robb、John B. Bicking、L. Sherman Watson、Edward J. Cragoe

  DOI：10.1021/jm00229a024

  日期：1976.7

  A variety of [(2-substituted and 2,2-disubstituted vinyl)aryloxy]acetic acids was synthesized in which the substituents were primarily electron-withdrawing groups. These compounds were tested in dogs for their saluretic and diuretic properties. Many of the compounds exhibited significant activity; however, they were generally less potent than those reported in the three earlier papers in this series.