伊伐布雷定杂质70 | 79623-31-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 伊伐布雷定杂质70
• 英文名称: N-methyl-3-(3,4-dimethoxyphenyl)propionamide
• 英文别名: 3-(3,4-dimethoxyphenyl)-N-methylpropanamide
• CAS: 79623-31-7
• 化学式: C₁₂H₁₇NO₃
• 分子量: 223.272
• InChiKey: SPVFMJNOROBLGX-UHFFFAOYSA-N

物化性质

• 熔点：
  68-70 °C(Solv: acetic acid (64-19-7))
• 沸点：
  405.5±35.0 °C(Predicted)
• 密度：
  1.067±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  47.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  伊伐布雷定杂质70 在 三氟乙酸 、 lithium diisopropyl amide 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 27.0h， 生成 4-butyl-7,8-dimethoxy-2-methyl-4,5-dihydro-1H-benzo[c]-azepin-3(2H)-one
  参考文献：
  名称：

  Concise Synthesis of 2-Benzazepine Derivatives and Their Biological Activity

  摘要：

  2-Benzazepines, which are potentially good candidates for new drug therapies to treat skin wounds, were readily prepared from substituted cinnamylamide via an intramolecular Friedel Crafts reaction. With few steps and effective reactions, the procedure enables a rapid derivatization of 2-benzazepines. Moreover, optically active 4-substituted-2-benzazepines were prepared from chiral alpha-substituted cinnamylamides, which were readily prepared by asymmetric alpha-alkylation of chiral cinnamyl oxazolidinone amides. We have easily prepared a library of more than 20 derivatives and examined the biological activity of the compounds.

  DOI：

  10.1021/jo300380z
• 作为产物：
  描述：

  3,4-二甲氧基苯丙酸 在 氯化亚砜 、 碳酸氢钠 作用下， 以 四氢呋喃 、 二氯甲烷 、 水 为溶剂， 反应 5.0h， 生成 伊伐布雷定杂质70
  参考文献：
  名称：

  Concise Synthesis of 2-Benzazepine Derivatives and Their Biological Activity

  摘要：

  2-Benzazepines, which are potentially good candidates for new drug therapies to treat skin wounds, were readily prepared from substituted cinnamylamide via an intramolecular Friedel Crafts reaction. With few steps and effective reactions, the procedure enables a rapid derivatization of 2-benzazepines. Moreover, optically active 4-substituted-2-benzazepines were prepared from chiral alpha-substituted cinnamylamides, which were readily prepared by asymmetric alpha-alkylation of chiral cinnamyl oxazolidinone amides. We have easily prepared a library of more than 20 derivatives and examined the biological activity of the compounds.

  DOI：

  10.1021/jo300380z

文献信息

• Peg-based adhesive phenylic derivatives and methods of synthesis and use
  申请人：MURPHY John L.

  公开号：US20160032047A1

  公开（公告）日：2016-02-04

  The invention provides compositions that use phenylic derivatives to provide adhesive properties. Selection of phenylic derivatives with linkers or linking groups, and the linkages between the linkers or linking groups with polyalkylene oxides, provided herein may be configured to control curing time, biodegradation and/or swelling.

  本发明提供了使用苯基衍生物作为黏合剂的组合物。本发明提供了苯基衍生物与连接剂或连接基团的选择，以及连接剂或连接基团与聚烷氧化物之间的连接，可以配置以控制固化时间、生物降解和/或肿胀。
• Thallium in organic synthesis. 61. Intramolecular capture of radical cations from thallium(III) trifluoroacetate oxidation of arylalkanoic acids and arylalkanols. New routes to oxygen heterocycles
  作者：Edward C. Taylor、Juan G. Andrade、Gerhardus J. H. Rall、Ignatius J. Turchi、Kosta Steliou、G. Erik Jagdmann、Alexander McKillop

  DOI：10.1021/ja00413a013

  日期：1981.11
• Kano, Shinzo; Yokomatsu, Tsutomu; Yuasa, Yoko, Heterocycles, 1983, vol. 20, # 1, p. 165
  作者：Kano, Shinzo、Yokomatsu, Tsutomu、Yuasa, Yoko、Shibuya, Shiroshi

  DOI：——

  日期：——
• Kano, Shinzo; Yokomatsu, Tsutomu; Yuasa, Yoko, Heterocycles, 1984, vol. 21, # 2, p. 700
  作者：Kano, Shinzo、Yokomatsu, Tsutomu、Yuasa, Yoko

  DOI：——

  日期：——
• KANO, SHINZO;YOKOMATSU, TSUTOMU;YUASA, YOKO;SHIBUYA, SHIROSHI, HETEROCYCLES, 1983, 20, N 1, 165
  作者：KANO, SHINZO、YOKOMATSU, TSUTOMU、YUASA, YOKO、SHIBUYA, SHIROSHI

  DOI：——

  日期：——