n-propargyl-anthraquinone-2,3-dicarboximide | 1202398-47-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: n-propargyl-anthraquinone-2,3-dicarboximide
• 英文别名: 2-Prop-2-ynylnaphtho[2,3-f]isoindole-1,3,5,10-tetrone
• CAS: 1202398-47-7
• 化学式: C₁₉H₉NO₄
• 分子量: 315.285
• InChiKey: YTFDMCRYVVKQMT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  24
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  71.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  9,10-anthraquinone-2,3-dicarboxylic anhydride 、 炔丙胺 以 N,N-二甲基甲酰胺 为溶剂， 反应 84.0h， 以47%的产率得到n-propargyl-anthraquinone-2,3-dicarboximide
  参考文献：
  名称：

  Synthesis, Electrochemistry, and Hydrolysis of Anthraquinone Derivatives

  摘要：

  Anthraquinone (AQ) derivatives, including members of the anthraquinone imide (AQI) family, have been synthesized to afford good candidates for electron-transfer studies in DNA. Electron-withdrawing groups on the AQ ring give a less negative reduction potential, as desired. As expected, the AQI derivatives have less negative reduction potentials than AQ derivatives. The AQI ring system has a half-life for hydrolysis of about 75min in a 3:7 MeCN and 0.005M K2CO3 in MeOH.

  DOI：

  10.1080/00397910902898585

文献信息

• Synthesis, Electrochemistry, and Hydrolysis of Anthraquinone Derivatives
  作者：Yu Cao、Daniel J. Rabinowitz、Dabney W. Dixon、Thomas L. Netzel

  DOI：10.1080/00397910902898585

  日期：2009.11.5

  Anthraquinone (AQ) derivatives, including members of the anthraquinone imide (AQI) family, have been synthesized to afford good candidates for electron-transfer studies in DNA. Electron-withdrawing groups on the AQ ring give a less negative reduction potential, as desired. As expected, the AQI derivatives have less negative reduction potentials than AQ derivatives. The AQI ring system has a half-life for hydrolysis of about 75min in a 3:7 MeCN and 0.005M K2CO3 in MeOH.