2-ethyl-malonamic acid ethyl ester

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 2-ethyl-malonamic acid ethyl ester
• 英文别名: 2-Aethyl-malonamidsaeure-aethylester；2-Carbamoyl-buttersaeureethylester；Ethyl 2-carbamoylbutanoate
• 化学式: C₇H₁₃NO₃
• 分子量: 159.185
• InChiKey: GNWODZQWJXOFRC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  11
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  69.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  ethyl 2-(chlorocarbonyl)butanoate 、 2-ethyl-malonamic acid ethyl ester 生成 2--buttersaeure-ethylester
  参考文献：
  名称：

  BUTTINI; GALIMBERTI; GEROSA, Bollettino Chimico Farmaceutico, 1961, vol. 100, p. 411 - 424

  摘要：

  DOI：
• 作为产物：
  描述：

  ethyl 2-(chlorocarbonyl)butanoate 在 氨 、 苯 作用下， 生成 2-ethyl-malonamic acid ethyl ester
  参考文献：
  名称：

  Marguery, Bulletin de la Societe Chimique de France, 1905, vol. <3> 33, p. 550

  摘要：

  DOI：

文献信息

• ARYLATED BETA-DICARBONYL COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF
  申请人：Santosh Mhaske Baburao

  公开号：US20140228592A1

  公开（公告）日：2014-08-14

  The invention discloses a one pot process for the arylation of β-dicarbonyl compounds. Particularly, the present invention discloses transition-metal-free, chemo-selective, one pot process for the C-arylation of malonamide esters having Formula I at room temperature provide temperature range to obtain the arylated compounds of formula II with good yield, wherein the arylated compounds are selected from mono-arylated compound and di-arylated compound or mixture thereof.

  该发明揭示了一种一锅法用于β-二羰基化合物的芳基化过程。具体地，本发明揭示了一种无过渡金属、化学选择性的一锅法过程，用于在室温下对具有式I的马隆酰胺酯进行C-芳基化，提供温度范围以获得式II的芳基化化合物，并且收率良好，其中所述芳基化合物选自单芳基化合物和双芳基化合物或二者的混合物。
• Synthesis and tautomerism of 1-substituted 3,3-dialkyl-3,4-dihydroisoquinolines
  作者：B. B. Aleksandrov、M. S. Gavrilov、M. I. Vakhrin、V. S. Shklyaev

  DOI：10.1007/bf00515067

  日期：1985.6
• Fischer,E.; Dilthey, Chemische Berichte, 1902, vol. 35, p. 855
  作者：Fischer,E.、Dilthey

  DOI：——

  日期：——
• Reactions of 2-alkylsulfanyl- and 2-alkoxy-4-hydroxy-6H-1,3-oxazin-6-ones with O-nucleophiles
  作者：B. Yu. Lalaev、I. P. Yakovlev、N. N. Kuz’mich、G. V. Ksenofontova、V. E. Zakhs

  DOI：10.1134/s1070363210100269

  日期：2010.10

  Reactions of 2-alkylsulfanyl- and 2-alkoxy-4-hydroxy-6H-1,3-oxazin-6-ones with oxygen-centered nucleophiles were studied. 2-Alkoxy-4-hydroxy-6H-1,3-oxazin-6-ones reacted with water and alcohols to give the corresponding alkyl 3-amino-3-oxopropanoates as a result of opening of the oxazine ring at the C(6)-O bond, whereas their 2-alkylsulfanyl analogs turned out to be stable toward O-nucleophiles. The different reactivities of the title compounds were interpreted in terms of quantum-chemical calculations of their electronic structure.
• ALEKSANDROV, B. B.;GAVRILOV, M. S.;VAXRIN, M. I.;SHKLYAEV, V. S., XIMIYA GETEROTSIKL. SOEDIN., 1985, N 6, 794-797
  作者：ALEKSANDROV, B. B.、GAVRILOV, M. S.、VAXRIN, M. I.、SHKLYAEV, V. S.

  DOI：——

  日期：——