1-[[2-[2-[2-[2-[(2-Hydroxynaphthalen-1-yl)methylideneamino]phenoxy]ethoxy]ethoxy]phenyl]iminomethyl]naphthalen-2-ol | 648894-45-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-[[2-[2-[2-[2-[(2-Hydroxynaphthalen-1-yl)methylideneamino]phenoxy]ethoxy]ethoxy]phenyl]iminomethyl]naphthalen-2-ol
• CAS: 648894-45-5
• 化学式: C₃₈H₃₂N₂O₅
• 分子量: 596.682
• InChiKey: WZSCIWMDZLUOCX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.8
• 重原子数：
  45
• 可旋转键数：
  12
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  92.9
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  cadmium(II) perchlorate hexahydrate 、 1-[[2-[2-[2-[2-[(2-Hydroxynaphthalen-1-yl)methylideneamino]phenoxy]ethoxy]ethoxy]phenyl]iminomethyl]naphthalen-2-ol 以 乙醇 、 二甲基亚砜 、 丙酮 为溶剂， 以22%的产率得到
  参考文献：
  名称：

  Exploiting anionic and cationic interactions with a new emissive imine-based β-naphthol molecular probe

  摘要：

  A new emissive molecular probe derived from 1,7-bis(2'-formylphenyl)-1,4,7-trioxaheptane and 2-hydroxy-1-naphthaldehyde has been synthesized by a Schiff-base condensation method. Its sensor capability towards cations such as Cu2+, Zn2+, Cd2+ and Hg2+, and anions such as halides (F-, Cl-, Br- and I-) and CN- was explored in DMSO solution. The geometry was optimized using density functional theory (DFT). The probe showed remarkable selectivity for Cu2+ and interaction with the more basic anions CN- and F-. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2009.07.011