3-phenyl-3-(3,5-dioxo-4-azatricyclo[5.2.1.0^{2-endo,6-endo}]dec-8-en-4-yl)propanoic acid

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 苯丙酸
• 英文名称: 3-phenyl-3-(3,5-dioxo-4-azatricyclo[5.2.1.0^{2-endo,6-endo}]dec-8-en-4-yl)propanoic acid
• 英文别名: (3R)-3-[(1S,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-3-phenylpropanoic acid
• 化学式: C₁₈H₁₇NO₄
• 分子量: 311.337
• InChiKey: KIWDBTUOHANCFV-RHBQXOTJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.01
• 重原子数：
  23.0
• 可旋转键数：
  4.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  74.68
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  4-nitrophenyl azide 、 3-phenyl-3-(3,5-dioxo-4-azatricyclo[5.2.1.0^{2-endo,6-endo}]dec-8-en-4-yl)propanoic acid 以 氯仿 为溶剂， 以70%的产率得到3-phenyl-3-{9-(4-nitrophenyl)-3,5-dioxo-4,9-diazatetracyclo[5.3.1.0^{2-endo,6-endo}.0^8-exo,10-exo]undec-4-yl}propanoic acid
  参考文献：
  名称：

  Features of reactions between (3,5-dioxo-4-azatricyclo-[5.2.1.02-endo,6-endo ]dec-8-en-4-yl)carboxylic acids and p-nitrophenyl azide

  摘要：

  Reactions were performed of (3,5-dioxo-4-azatricyclo[5.2.1.0(2-endo,6-endo) ]dec-8-en-4-yl)carboxylic acids and their derivatives with p-nitrophenyl azide. A significant fact of the involvement of the carboxy group into the formation of aziridine ring was established and the intermolecular character of this process was confirmed. The structure of compounds synthesized was proved by IR and H-1 NMR spectra.

  DOI：

  10.1134/s1070428009020146
• 作为产物：
  描述：

  (R)-3-氨基-3-苯基丙酸 、 3,6-endomethylene-1,2,3,6-tetrahydrophthalic anhydride 在 溶剂黄146 作用下， 以85%的产率得到3-phenyl-3-(3,5-dioxo-4-azatricyclo[5.2.1.0^{2-endo,6-endo}]dec-8-en-4-yl)propanoic acid
  参考文献：
  名称：

  Features of reactions between (3,5-dioxo-4-azatricyclo-[5.2.1.02-endo,6-endo ]dec-8-en-4-yl)carboxylic acids and p-nitrophenyl azide

  摘要：

  Reactions were performed of (3,5-dioxo-4-azatricyclo[5.2.1.0(2-endo,6-endo) ]dec-8-en-4-yl)carboxylic acids and their derivatives with p-nitrophenyl azide. A significant fact of the involvement of the carboxy group into the formation of aziridine ring was established and the intermolecular character of this process was confirmed. The structure of compounds synthesized was proved by IR and H-1 NMR spectra.

  DOI：

  10.1134/s1070428009020146

文献信息

• Features of reactions between (3,5-dioxo-4-azatricyclo-[5.2.1.02-endo,6-endo ]dec-8-en-4-yl)carboxylic acids and p-nitrophenyl azide
  作者：I. N. Tarabara、Ya. S. Bondarenko、L. I. Kas’yan

  DOI：10.1134/s1070428009020146

  日期：2009.2

  Reactions were performed of (3,5-dioxo-4-azatricyclo[5.2.1.0(2-endo,6-endo) ]dec-8-en-4-yl)carboxylic acids and their derivatives with p-nitrophenyl azide. A significant fact of the involvement of the carboxy group into the formation of aziridine ring was established and the intermolecular character of this process was confirmed. The structure of compounds synthesized was proved by IR and H-1 NMR spectra.