2-(4-((2-ethylhexyl)oxy)phenyl)-1-hexyl-1H-dithieno[2',3':3,4;3'',2'':5,6]benzo[1,2-d]imidazole | 1375171-36-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 2-(4-((2-ethylhexyl)oxy)phenyl)-1-hexyl-1H-dithieno[2',3':3,4;3'',2'':5,6]benzo[1,2-d]imidazole
• 英文别名: 4-[4-(2-Ethylhexoxy)phenyl]-5-hexyl-8,15-dithia-3,5-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-1,3,6,9,11,13-hexaene；4-[4-(2-ethylhexoxy)phenyl]-5-hexyl-8,15-dithia-3,5-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-1,3,6,9,11,13-hexaene
• CAS: 1375171-36-0
• 化学式: C₃₁H₃₈N₂OS₂
• 分子量: 518.788
• InChiKey: LOAVNEJQXKMWDC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.5
• 重原子数：
  36
• 可旋转键数：
  13
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  83.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-(4-((2-ethylhexyl)oxy)phenyl)-1-hexyl-1H-dithieno[2',3':3,4;3'',2'':5,6]benzo[1,2-d]imidazole 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 四氢呋喃 为溶剂， 以95.4%的产率得到5,8-dibromo-2-(4-((2-ethylhexyl)oxy)phenyl)-1-hexyl-1H-dithieno[2',3':3,4;3'',2'':5,6]benzo[1,2-d]imidazole
  参考文献：
  名称：

  Novel Thieno-imidazole Based Probe for Colorimetric Detection of Hg²⁺ and Fluorescence Turn-on Response of Zn²⁺

  摘要：

  Novel thieno-imidazole based polymer P showed both colorimetric and ratiometric detections of Hg2+ as well as fluorometric detection of Zn2+ via fluorescence turn-on response with augmented lifetime. Its model polymer M did not show any such sensing capability under similar conditions, which further confirmed the unique sensitivity of P toward Hg2+ and Zn2+ via the chelation of metal ions to both "S" and "N" heteroatoms.

  DOI：

  10.1021/ol300867e
• 作为产物：
  描述：

  苯并二噻吩-4,5-二酮 在 ammonium acetate 、 potassium carbonate 、 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 2.0h， 生成 2-(4-((2-ethylhexyl)oxy)phenyl)-1-hexyl-1H-dithieno[2',3':3,4;3'',2'':5,6]benzo[1,2-d]imidazole
  参考文献：
  名称：

  Novel Thieno-imidazole Based Probe for Colorimetric Detection of Hg²⁺ and Fluorescence Turn-on Response of Zn²⁺

  摘要：

  Novel thieno-imidazole based polymer P showed both colorimetric and ratiometric detections of Hg2+ as well as fluorometric detection of Zn2+ via fluorescence turn-on response with augmented lifetime. Its model polymer M did not show any such sensing capability under similar conditions, which further confirmed the unique sensitivity of P toward Hg2+ and Zn2+ via the chelation of metal ions to both "S" and "N" heteroatoms.

  DOI：

  10.1021/ol300867e

文献信息

• Novel Thieno-imidazole Based Probe for Colorimetric Detection of Hg²⁺ and Fluorescence Turn-on Response of Zn²⁺
  作者：Rudrakanta Satapathy、Yen-Hsing Wu、Hong-Cheu Lin

  DOI：10.1021/ol300867e

  日期：2012.5.18

  Novel thieno-imidazole based polymer P showed both colorimetric and ratiometric detections of Hg2+ as well as fluorometric detection of Zn2+ via fluorescence turn-on response with augmented lifetime. Its model polymer M did not show any such sensing capability under similar conditions, which further confirmed the unique sensitivity of P toward Hg2+ and Zn2+ via the chelation of metal ions to both "S" and "N" heteroatoms.