2-{(E)-2-[acetyl(phenyl)amino]ethenyl}-3,3-dimethyl-1-propylindolium | 873293-49-3

• 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-{(E)-2-[acetyl(phenyl)amino]ethenyl}-3,3-dimethyl-1-propylindolium
• 英文别名: N-[(E)-2-(3,3-dimethyl-1-propylindol-1-ium-2-yl)ethenyl]-N-phenylacetamide
• CAS: 873293-49-3
• 化学式: C₂₃H₂₇N₂O
• 分子量: 347.48
• InChiKey: RCGSKVMVRSUHHQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  23.3
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2-{(E)-2-[acetyl(phenyl)amino]ethenyl}-3,3-dimethyl-1-propylindolium 在 吡啶 、 三乙胺 作用下， 以 乙醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 2.0h， 生成 2-[3-(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)-1-propenyl]-1-[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-3,3-dimethyl-3H-indolium
  参考文献：
  名称：

  Practical syntheses of dyes for difference gel electrophoresis

  摘要：

  The three dyes (two indocyanine and one berizoxazolium) useful in difference gel electrophoresis-methyl Cy5 1, propyl Cy3 2, and the benzoxazolium dye Cy2 3-and their NHS esters have been prepared by efficient routes in good overall yield from inexpensive precursors. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2005.07.068
• 作为产物：
  描述：

  2,3,3-三甲基-3H-吲哚 以 邻二氯苯 为溶剂， 反应 24.5h， 生成 2-{(E)-2-[acetyl(phenyl)amino]ethenyl}-3,3-dimethyl-1-propylindolium
  参考文献：
  名称：

  Practical syntheses of dyes for difference gel electrophoresis

  摘要：

  The three dyes (two indocyanine and one berizoxazolium) useful in difference gel electrophoresis-methyl Cy5 1, propyl Cy3 2, and the benzoxazolium dye Cy2 3-and their NHS esters have been prepared by efficient routes in good overall yield from inexpensive precursors. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2005.07.068

文献信息

• Trimethine Cyanine Compounds, Their Preparation and Their Use
  申请人：Sha Chin Kang

  公开号：US20100068442A1

  公开（公告）日：2010-03-18

  The present invention relates to a trimethine cyanine represented by the formula (1): wherein each symbols are defined in the specification. The present invention also relates to a use of the above dimeric trimethine cyanine compound for as a dye, which is used in optic element, particularly a high density recordable optical media.

  本发明涉及一种由式(1)表示的三甲基青霉素，其中每个符号在规范中定义。本发明还涉及上述二聚体三甲基青霉素化合物作为染料的用途，该染料用于光学元件，特别是高密度可记录光学介质。
• TRIMETHINE CYANINE AND ITS USE
  申请人：Sha Chin-Kang

  公开号：US20130060046A1

  公开（公告）日：2013-03-07

  The present invention relates to a trimethine cyanine represented by the formula (1): wherein all symbols are defined as in the specification.

  本发明涉及一种由式（1）表示的三甲基青光染料：其中所有符号如规范中定义的。
• US8168282B2
  申请人：——

  公开号：US8168282B2

  公开（公告）日：2012-05-01
• US8759534B2
  申请人：——

  公开号：US8759534B2

  公开（公告）日：2014-06-24
• Practical syntheses of dyes for difference gel electrophoresis
  作者：Michael E. Jung、Wan-Joong Kim

  DOI：10.1016/j.bmc.2005.07.068

  日期：2006.1

  The three dyes (two indocyanine and one berizoxazolium) useful in difference gel electrophoresis-methyl Cy5 1, propyl Cy3 2, and the benzoxazolium dye Cy2 3-and their NHS esters have been prepared by efficient routes in good overall yield from inexpensive precursors. (c) 2005 Elsevier Ltd. All rights reserved.