N1,N3-diethylmalonamide | 10570-32-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N1,N3-diethylmalonamide
• 英文别名: N,N'-Diaethyl-malonamid；Malonsaeurediaethylamid；N,N'-Diethyl-malonsaeure-diamid；N,N'-diethylmalondiamide；N,N'-diethyl-malonamide；Malonsaeure-bis-aethylamid；N,N'-diethylpropanediamide
• CAS: 10570-32-8
• 化学式: C₇H₁₄N₂O₂
• mdl: MFCD00459784
• 分子量: 158.2
• InChiKey: YMTUEKLZYBEJSW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.3
• 重原子数：
  11
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.714
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N1,N3-diethylmalonamide 在 tetraphosphorus decasulfide 作用下， 以 xylene 为溶剂， 生成 N,N'-diethyldithiomalonamide
  参考文献：
  名称：

  Kisenyi, Jonathan M.; Willey, Gerald R.; Drew, Michael G. B., Journal of the Chemical Society, Dalton Transactions, 1985, p. 1073 - 1076

  摘要：

  DOI：
• 作为产物：
  描述：

  BrCH(CONHEt)2 在 溶剂黄146 、 potassium iodide 作用下， 生成 N1,N3-diethylmalonamide
  参考文献：
  名称：

  Backes; West; Whiteley, Journal of the Chemical Society, 1921, vol. 119, p. 360

  摘要：

  DOI：

文献信息

• KI-catalyzed C–S bond formation <i>via</i> an oxidation relay strategy: efficient access to various α-thio-β-dicarbonyl compounds
  作者：Yi Jiang、Jiao-Xia Zou、Long-Tao Huang、Xue Peng、Jie-Dan Deng、Long-Qing Zhu、Yu-Hang Yang、Yi-Yue Feng、Xiao-Yun Zhang、Zhen Wang

  DOI：10.1039/c8ob00080h

  日期：——

  An efficient and practical methodology to obtain α-thio-β-dicarbonyl compounds was presented under alkaline conditions via potassium iodide (KI) catalysis.

  在碱性条件下，通过碘化钾（KI）催化，提出了一种获得α-硫代-β-二羰基化合物的高效实用方法。
• Enols of 2-nitro- and related 2-substituted malonamides
  作者：Ahmad Basheer、Masaaki Mishima、Zvi Rappoport

  DOI：10.1002/poc.1611

  日期：——

  The structures of 2‐substituted malonamides, YCH(CONR1R2)CONR3R4 (Y = Br, SO2Me, CONH2, COMe, and NO2) were investigated. When Y = Br, R1R2 = R3R4 = HEt; Y = SO2Me, R1–R4 = H and for Y = CONH2 or CONHPh, R1–R4 = Me, the structure in solution is that of the amide tautomer. X‐ray crystallography shows solid‐state amide structures for Y = SO2Me or CONH2, R1–R4 = H. Nitromalonamide displays an enol structure

  研究了2-取代的丙二酰胺YCH（CONR 1 R 2）CONR 3 R 4（Y = Br，SO 2 Me，CONH 2，COMe和NO 2）的结构。当Y ＝ Br时，R 1 R 2  ＝ R 3 R 4  ＝ HEt。Y = SO 2 Me，R 1 -R 4  = H，对于Y = CONH 2或CONHPh，R 1 -R 4  = Me，溶液中的结构是酰胺互变异构体。X射线晶体学显示Y = SO 2 Me或CONH 2的固态酰胺结构，R 1 -R 4  =H。硝基丙二酰胺在固态下显示具有强氢键的烯醇结构（在100 K时O … O距离= 2.3730Å），并且d（OH）≠d（O … H）。在溶液中观察到明显的对称烯醇，即使在高极性溶剂（如DMSO-d 6）中也占相当大的百分比，但随着溶剂极性的增加，K烯醇值会降低。的Ñ，Ñ ' -二甲基衍生物是以下烯醇。乙酰丙二酰胺在非极性溶剂中显示出乙酰基
• Process of preparing paroxetine and intermediates for use therein
  申请人：——

  公开号：US20040073038A1

  公开（公告）日：2004-04-15

  A process of preparing paroxetine, a process for preparing intermediates for use in the preparation of paroxetine and specific intermediates useful in paroxetine preparation. The specific intermediates that can be employed include compounds of formulae (V), (VI), or (VII). 1

  制备帕罗西汀的过程，制备用于制备帕罗西汀的中间体的过程以及在帕罗西汀制备中有用的特定中间体。可用的特定中间体包括公式（V）、（VI）或（VII）的化合物。
• NOVEL SUBSTRATES OF O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE AND MUTANTS THEREOF
  申请人：Bourrier Emmanuel

  公开号：US20110236952A1

  公开（公告）日：2011-09-29

  The invention relates to compounds of formula (I′): in which A, L 2 , M and B are as defined in the description. These compounds are substrates of O 6 -alkylguanine-DNA alkyltransferase and mutants

  本发明涉及式(I')的化合物： 其中，A，L2，M和B如描述中所定义。这些化合物是O6-烷基鸟嘌呤-DNA烷基转移酶和突变体的底物。
• Modifiable polyunsaturated polymers and processes for their preparation
  申请人：Parthiban Anbanandam

  公开号：US20060189774A1

  公开（公告）日：2006-08-24

  The present invention relates to modifiable linear polyunsaturated polymers and processes for preparing the same comprising reacting solely at least one bifunctional nucleophilic compound with at least one α-functional unsaturated monomer. The at least one bifunctional nucleophilic compound of the invention comprises two nucleophiles independently selected from the group consisting of C, N, O, S and Se. The at least one α-functional unsaturated monomer of the invention comprises two leaving groups L 1 and L 2 , wherein at least one of the leaving groups L 1 and L 2 of the at least one α-functional unsaturated monomer is part of the nonaromatic unsaturated structure C═C—C α -L. The double bond of said α-functional unsaturated monomer is maintained in the polyunsaturated polymer.

  本发明涉及可改性线性多不饱和聚合物以及制备该聚合物的工艺，包括仅使至少一种双官能团亲核化合物与至少一种α官能团不饱和单体反应。本发明的至少一种双官能团亲核化合物包括两个独立选自 C、N、O、S 和 Se 组的亲核物。本发明的至少一种 α-官能团不饱和单体包括两个离去基团 L 1 和 L 2 其中至少一个离去基团 L 1 和 L 2 的至少一个离去基团 L 1 和 L 2 是非芳香族不饱和结构 C═C-C α -L.所述 α-官能团不饱和单体的双键保留在多不饱和聚合物中。