6-(4-Fluorophenyl)-5-iodonaphtho[1,2-b][1]benzothiole | 1367458-49-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 6-(4-Fluorophenyl)-5-iodonaphtho[1,2-b][1]benzothiole
• CAS: 1367458-49-8
• 化学式: C₂₂H₁₂FIS
• 分子量: 454.306
• InChiKey: FXOBYEILIRZQSE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  25
• 可旋转键数：
  1
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  28.2
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1-Fluoro-4-[2-[2-[2-(2-methylsulfanylphenyl)ethynyl]phenyl]ethynyl]benzene 在 碘 作用下， 以 硝基甲烷 为溶剂， 反应 0.5h， 以85%的产率得到6-(4-Fluorophenyl)-5-iodonaphtho[1,2-b][1]benzothiole
  参考文献：
  名称：

  Cascade cyclization of aryldiynes using iodine: synthesis of iodo-substituted benzo[b]naphtho[2,1-d]thiophene derivatives for dye-sensitized solar cells

  摘要：

  A facile, efficient, and general synthetic method for iodo-substituted benzo[b]naphtho[2,1-d]thiophenes has been developed via a cascade cyclization of thioanisole-substituted aryldiynes using iodine. A new donor-pi linker-acceptor (D-pi-A) organic dye, G1, with the benzo[b]naphtho[2,1-d]thiophene moiety as an electron donor has been synthesized, and the performance of dye-sensitized solar cell based on G1 has been investigated. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.02.007