α-Cyan-β--acrylsaeureethylester | 67964-19-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: α-Cyan-β--acrylsaeureethylester
• 英文别名: ethyl 2-cyano-3-[(4-methoxyphenyl)amino]acrylate；3-p-anisidino-2-cyano-acrylic acid ethyl ester；3-(4-Methoxy-phenylimino)-2-cyan-propionsaeure-aethylester；3-p-Anisidino-2-cyan-acrylsaeure-aethylester；Ethyl 2-cyano-3-[(4-methoxyphenyl)amino]prop-2-enoate；ethyl 2-cyano-3-(4-methoxyanilino)prop-2-enoate
• CAS: 67964-19-6
• 化学式: C₁₃H₁₄N₂O₃
• 分子量: 246.266
• InChiKey: ALXBEFGGJFWDHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  71.4
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  trans-(bromomesityl)bis(triphenylphosphino)nickel(II) 、 α-Cyan-β--acrylsaeureethylester 在 sodium bis(trimethylsilyl)amide 作用下， 以 甲苯 为溶剂， 以71%的产率得到[ethyl 2-cyano-3-[(4-methoxyphenyl)amino]acrylatemesityl](triphenylphosphino)nickel(II)
  参考文献：
  名称：

  3-Aminoiminoacrylate, 3-Aminoacrylate, and 3-Amidoiminomalonate Complexes as Catalysts for the Dimerization of Olefins

  摘要：

  Nickel(II)-aminoacrylate, -aminoiminoacrylate, and -amidoiminomalonate complexes 1-4 are suitable precursors together with appropriate cocatalysts for the catalytic dimerization of ethylene, propylene, and alpha-olefins with short chain lengths such as 1-hexene. Suitable ligands IV-VI, VIII, X, and XII generate nickel(II) compounds 1-4 active for these catalytic dimerizations. The influence of different substituents attached to the coordinating ligand backbone is tested in the catalytic reactions. Several novel monodentate and chelate nickel(II) precursor complexes 1 and 3 were isolated and also characterized by X-ray structure analysis.

  DOI：

  10.1021/om049075s
• 作为产物：
  描述：

  甲氧苯胺 、 原甲酸三乙酯 、 氰乙酸乙酯 生成 α-Cyan-β--acrylsaeureethylester
  参考文献：
  名称：

  4-羟基喹啉的合成；通过双-（间氯苯基）-甲am的改性制剂。

  摘要：

  DOI：

  10.1021/ja01211a035

文献信息

• Synthesis of 4-Hydroxyquinolines. IV. A Modified Preparation through bis-(m-Chlorophenyl)-formamidine¹
  作者：Charles C. Price、Royston M. Roberts

  DOI：10.1021/ja01211a035

  日期：1946.7
• 3-Aminoiminoacrylate, 3-Aminoacrylate, and 3-Amidoiminomalonate Complexes as Catalysts for the Dimerization of Olefins
  作者：Martin E. Bluhm、Cristina Folli、Daniela Pufky、Mario Kröger、Olaf Walter、Manfred Döring

  DOI：10.1021/om049075s

  日期：2005.8.1

  Nickel(II)-aminoacrylate, -aminoiminoacrylate, and -amidoiminomalonate complexes 1-4 are suitable precursors together with appropriate cocatalysts for the catalytic dimerization of ethylene, propylene, and alpha-olefins with short chain lengths such as 1-hexene. Suitable ligands IV-VI, VIII, X, and XII generate nickel(II) compounds 1-4 active for these catalytic dimerizations. The influence of different substituents attached to the coordinating ligand backbone is tested in the catalytic reactions. Several novel monodentate and chelate nickel(II) precursor complexes 1 and 3 were isolated and also characterized by X-ray structure analysis.