2-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy)acetic acid | 1365542-25-1

• 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-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy)acetic acid
• 英文别名: 2-(4-Chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1h-pyrazol-3yl)phenoxy)acetic acid；2-[4-chloro-2-[2-(6-chloropyridazin-3-yl)-3-phenyl-3,4-dihydropyrazol-5-yl]phenoxy]acetic acid
• CAS: 1365542-25-1
• 化学式: C₂₁H₁₆Cl₂N₄O₃
• 分子量: 443.289
• InChiKey: QGRWXMUOOMBWKH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  87.9
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  ethyl 2-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy) acetate 在 水 、 potassium hydroxide 、 盐酸 作用下， 以 乙醇 、 水 为溶剂， 反应 1.5h， 以93%的产率得到2-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy)acetic acid
  参考文献：
  名称：

  A new highly selective “turn on” fluorescent sensor for zinc ion based on a pyrazoline derivative

  摘要：

  A novel pyrazoline derivative, 2-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy)acetic acid, was synthesized starting from a chalcone and 3-chloro-6-hydrazinylpyridazine and proposed for the determination of Zn2+ ion with high selectivity and a low detection limit in CH3CN:EtOH (90/10, v/v). This sensor formed a 1:1 complex with Zn2+ and showed a fluorescent enhancement with good tolerance of other metal ions. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jphotochem.2010.11.014

文献信息

• A new highly selective “turn on” fluorescent sensor for zinc ion based on a pyrazoline derivative
  作者：Zhong-Liang Gong、Bao-Xiang Zhao、Wei-Yong Liu、Hong-Shui Lv

  DOI：10.1016/j.jphotochem.2010.11.014

  日期：2011.2

  A novel pyrazoline derivative, 2-(4-chloro-2-(1-(6-chloropyridazin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenoxy)acetic acid, was synthesized starting from a chalcone and 3-chloro-6-hydrazinylpyridazine and proposed for the determination of Zn2+ ion with high selectivity and a low detection limit in CH3CN:EtOH (90/10, v/v). This sensor formed a 1:1 complex with Zn2+ and showed a fluorescent enhancement with good tolerance of other metal ions. (C) 2010 Elsevier B.V. All rights reserved.