N-Phenyl methyl-6 hexane lactame-6 | 75737-60-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 内酰胺类
• 英文名称: N-Phenyl methyl-6 hexane lactame-6
• 英文别名: 7-methyl-1-phenylazepan-2-one
• CAS: 75737-60-9
• 化学式: C₁₃H₁₇NO
• 分子量: 203.284
• InChiKey: QWWDUBDKGNPBLA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  (Methyl-2 cyclohexane)-1-spiro-3'-(phenyl-2' oxaziridine) 反应 672.0h， 生成 N-Phenyl methyl-6 hexane lactame-6 、 N-Phenyl methyl-2 hexane lactame-6
  参考文献：
  名称：

  Structural determination of ε-lactams by ¹ H and ¹³ C NMR

  摘要：

  AbstractThe thermodynamic products (ε‐lactams) of the degradation of ten different spirocyclic oxaziridines were analyzed by 1H and 13C NMR spectroscopy. The preferred conformations were determined by examining the homonuclear spin–spin coupling constant and the chemical shift effects of the N‐substituent and the alkyl group of the aliphatic ring on 1H and 13C NMR spectra. Copyright © 2009 John Wiley & Sons, Ltd.

  DOI：

  10.1002/mrc.2504

文献信息

• Cobalt‐Catalyzed Selective Transformation of Levulinic Acid and Amines into Pyrrolidines and Pyrrolidinones using Hydrogen
  作者：Yixiao Pan、Zhenli Luo、Ji Yang、Jiahong Han、Jianbo Yang、Zhen Yao、Lijin Xu、Peng Wang、Qian Shi

  DOI：10.1002/adsc.202200578

  日期：2022.8.16

  Cobalt-catalyzed selective transformation of levulinic acid and primary amines into pyrrolidines and pyrrolidinones under H2 has been developed. The catalyst system consisting of Co(NTf2)2, 1,1,1-tris(di(4-methoxyphenyl)phosphinomethyl) ethane ((p-anisyl)triphos) and Me3SiOTf works well for the synthesis of pyrrolidines via reductive amination/cyclization/deoxygenative reduction of amide, and using Co(NTf2)2/1

  已经开发了在 H 2下钴催化的乙酰丙酸和伯胺选择性转化为吡咯烷和吡咯烷酮。由Co(NTf 2 ) 2、1,1,1-三(二(4-甲氧基苯基)膦甲基)乙烷((对茴香基)三膦)和Me 3 SiOTf组成的催化剂体系适用于通过还原反应合成吡咯烷酰胺的胺化/环化/脱氧还原，并使用Co(NTf 2 ) 21,1,1-三(二苯基膦基甲基)乙烷(triphos)在氢气减压下作为催化剂导致仅形成吡咯烷酮。芳基和烷基伯胺都是合适的底物，并且可以容忍多种官能团。同时，4-氧代-4-芳基丁酸、5-氧代己酸、6-氧代庚酸、2-甲酰基苯甲酸、2-乙酰基苯甲酸和2'-乙酰基-[1,1'-联苯]-2-羧酸是也适用，允许方便地获得具有不同环大小的环胺和内酰胺。
• Oliveros, Esther; Riviere, Monique; Lattes, Armand, Journal of Heterocyclic Chemistry, 1980, vol. 17, p. 1025 - 1027
  作者：Oliveros, Esther、Riviere, Monique、Lattes, Armand

  DOI：——

  日期：——
• Structural determination of ε-lactams by ¹ H and ¹³ C NMR
  作者：Rubén Montalvo-González、Armando Ariza-Castolo

  DOI：10.1002/mrc.2504

  日期：2009.12

  AbstractThe thermodynamic products (ε‐lactams) of the degradation of ten different spirocyclic oxaziridines were analyzed by 1H and 13C NMR spectroscopy. The preferred conformations were determined by examining the homonuclear spin–spin coupling constant and the chemical shift effects of the N‐substituent and the alkyl group of the aliphatic ring on 1H and 13C NMR spectra. Copyright © 2009 John Wiley & Sons, Ltd.