(4R,5S)-1-(2-Chloro-propionyl)-3,4-dimethyl-5-phenyl-imidazolidin-2-one | 198344-33-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: (4R,5S)-1-(2-Chloro-propionyl)-3,4-dimethyl-5-phenyl-imidazolidin-2-one
• 英文别名: (4R,5S)-1-(2-chloropropanoyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
• CAS: 198344-33-1
• 化学式: C₁₄H₁₇ClN₂O₂
• 分子量: 280.754
• InChiKey: KGKWHXTYCJMVSF-GTFYECCDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  40.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-溴-6-甲氧基萘 、 (4R,5S)-1-(2-Chloro-propionyl)-3,4-dimethyl-5-phenyl-imidazolidin-2-one 在 (2,2'-bipyridine)nickel(II) dibromide 、 tetrabutylammonium tetrafluoroborate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 、 (4R,5S)-1-[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]-3,4-dimethyl-5-phenylimidazolidin-2-one
  参考文献：
  名称：

  Asymmetric Induction in the Electrochemical Cross-Coupling of Aryl Halides with α-Chloropropionic Acid Derivatives Catalyzed by Nickel Complexes

  摘要：

  DOI：

  10.1021/jo971279d
• 作为产物：
  描述：

  2-氯丙酰氯 、 lithium;(4S,5R)-1,5-dimethyl-4-phenylimidazolidin-3-id-2-one 生成 (4R,5S)-1-(2-Chloro-propionyl)-3,4-dimethyl-5-phenyl-imidazolidin-2-one
  参考文献：
  名称：

  Asymmetric Induction in the Electrochemical Cross-Coupling of Aryl Halides with α-Chloropropionic Acid Derivatives Catalyzed by Nickel Complexes

  摘要：

  DOI：

  10.1021/jo971279d

文献信息

• Nickel-Catalyzed Electrochemical Couplings of Vinyl Halides:  Synthetic and Stereochemical Aspects
  作者：C. Cannes、S. Condon、M. Durandetti、J. Périchon、J.-Y. Nédélec

  DOI：10.1021/jo000182f

  日期：2000.7.1

  Homo- and cross-coupling involving alkenyl halides have been performed efficiently using an electroassisted nickel-complex catalysis. Valuable product such as conjugated dienes, beta,gamma- or gamma,delta-unsaturated esters, ketones, or nitriles, as well as alkenylated aryl compounds are thus prepared with high yields and high stereoselectivity. Partial isomerization is only observed in a few cases, when the alkenyl halide is involved in a late step of the catalytic cycle. This is the case in the preparation of (Z,Z)-1,3-diene.