2',8'-diethyl-1,2,3,4,6,7,8,9-octafluoro-1',3',7',9'-tetramethyl-5l4-spiro[dibenzo[b,d]borole-5,5'-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin]-4'-ium | 1183676-01-8

• 英文名称: 2',8'-diethyl-1,2,3,4,6,7,8,9-octafluoro-1',3',7',9'-tetramethyl-5l4-spiro[dibenzo[b,d]borole-5,5'-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin]-4'-ium
• CAS: 1183676-01-8
• 化学式: C₂₉H₂₃BF₈N₂
• 分子量: 562.313
• InChiKey: OVFQNMRYPPQQML-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  1,3,7,9-tetramethyl-2,8-diethyl-4,6-dipyrrin hydrobromide 、 5-Bromo-1,2,3,4,6,7,8,9-octafluorobenzo[b][1]benzoborole 在 Et₃N 作用下， 以 二氯甲烷 为溶剂， 以62%的产率得到2',8'-diethyl-1,2,3,4,6,7,8,9-octafluoro-1',3',7',9'-tetramethyl-5l4-spiro[dibenzo[b,d]borole-5,5'-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin]-4'-ium
  参考文献：
  名称：

  Perfluoroaryl-Substituted Boron Dipyrrinato Complexes

  摘要：

  A methodology for the incorporation of fluoroaryl groups into boron dipyrrinato complexes (modified BODIPY dyes) is reported. Two hexaalkylated dipyrrinato ligands with either H or CH3 occupying the meso position were employed; when they were treated with fluoroaryl haloboranes in the presence of a weak base, the title compounds were prepared in good to excellent yields. The structures of seven derivatives were determined using X-ray crystallography, and their spectroscopic, photophysical, and redox properties are compared.

  DOI：

  10.1021/om900402e