10-(3,5-Dinitrobenzoyl)oxydecyl 3,5-dinitrobenzoate | 560120-55-0

• 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: 10-(3,5-Dinitrobenzoyl)oxydecyl 3,5-dinitrobenzoate
• 英文别名: 10-(3,5-dinitrobenzoyl)oxydecyl 3,5-dinitrobenzoate
• CAS: 560120-55-0
• 化学式: C₂₄H₂₆N₄O₁₂
• 分子量: 562.49
• InChiKey: ZTPCNLQNZGLLQZ-UHFFFAOYSA-N

物化性质

• 沸点：
  687.2±50.0 °C(Predicted)
• 密度：
  1.387±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.2
• 重原子数：
  40
• 可旋转键数：
  15
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  236
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  1,10-癸二醇 、 3,5-二硝基苯甲酸 在 4-二甲氨基吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 24.0h， 以21%的产率得到
  参考文献：
  名称：

  Preparation of two new [2]rotaxanes based on the pillar[5]arene/alkane recognition motif

  摘要：

  Based on the pillar[5]arene/alkane recognition motif, two [2]rotaxanes were successfully prepared. Their formation was confirmed by NMR spectroscopy and ESI mass spectrometry. We also demonstrated that 3,5-dinitrophenyl group and 3,5-bis(trifluoromethyl)phenyl group are big enough to work as stoppers for DPPillar[5]arene, which lays a foundation for the preparation of more complex and functional supramolecular structures. (C) 2012 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2012.05.028

文献信息

• Preparation of two new [2]rotaxanes based on the pillar[5]arene/alkane recognition motif
  作者：Shengyi Dong、Chengyou Han、Bo Zheng、Mingming Zhang、Feihe Huang

  DOI：10.1016/j.tetlet.2012.05.028

  日期：2012.7

  Based on the pillar[5]arene/alkane recognition motif, two [2]rotaxanes were successfully prepared. Their formation was confirmed by NMR spectroscopy and ESI mass spectrometry. We also demonstrated that 3,5-dinitrophenyl group and 3,5-bis(trifluoromethyl)phenyl group are big enough to work as stoppers for DPPillar[5]arene, which lays a foundation for the preparation of more complex and functional supramolecular structures. (C) 2012 Published by Elsevier Ltd.