(15-crown-5)-4-benzoic acid 2-tert-butoxycarbonylaminoethyl ester | 909804-21-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (15-crown-5)-4-benzoic acid 2-tert-butoxycarbonylaminoethyl ester
• 英文别名: 2-[(2-Methylpropan-2-yl)oxycarbonylamino]ethyl 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carboxylate
• CAS: 909804-21-3
• 化学式: C₂₂H₃₃NO₉
• 分子量: 455.505
• InChiKey: VKFXNURNTDUVBX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  32
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  111
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  (15-crown-5)-4-benzoic acid 2-tert-butoxycarbonylaminoethyl ester 在 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 以90.3%的产率得到(15-crown-5)-4-benzoic acid 2-aminoethyl ester
  参考文献：
  名称：

  EP1864968

  摘要：

  公开号：
• 作为产物：
  描述：

  4'-羧基苯并-15-冠5-醚 、 N-Boc-溴乙胺 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 2.0h， 以94.2%的产率得到(15-crown-5)-4-benzoic acid 2-tert-butoxycarbonylaminoethyl ester
  参考文献：
  名称：

  EP1864968

  摘要：

  公开号：

文献信息

• Complex Compound and MRI Probe Made of Same
  申请人：Suzuki Koji

  公开号：US20110165089A1

  公开（公告）日：2011-07-07

  Novel gadolinium complex compounds responsive to ions and compounds other than zinc ion, as well as MRI probes made of the compounds are disclosed. Since the gadolinium complex compounds of the present invention such as that represented by the following structural formula exhibit responsiveness to potassium ion, calcium ion, glucose or the like, by using the gadolinium complex compounds of the present invention as a MRI probe, the ion or compound in a living body can be detected and concentration distribution thereof may be determined.
• COMPLEX COMPOUND AND MRI PROBE MADE OF SAME
  申请人：SUZUKI Koji

  公开号：US20120093735A1

  公开（公告）日：2012-04-19

  Novel gadolinium complex compounds responsive to ions and compounds other than zinc ion, as well as MRI probes made of the compounds are disclosed. Since the gadolinium complex compounds of the present invention such as that represented by the following structural formula exhibit responsiveness to potassium ion, calcium ion, glucose or the like, by using the gadolinium complex compounds of the present invention as a MRI probe, the ion or compound in a living body can be detected and concentration distribution thereof may be determined.
• US8460636B2
  申请人：——

  公开号：US8460636B2

  公开（公告）日：2013-06-11
• EP1864968
  申请人：——

  公开号：——

  公开（公告）日：——