5-benzoyl-2-methoxyaniline | 71969-28-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 5-benzoyl-2-methoxyaniline
• 英文别名: (3-Amino-4-methoxyphenyl)(phenyl)methanone；(3-amino-4-methoxyphenyl)-phenylmethanone
• CAS: 71969-28-3
• 化学式: C₁₄H₁₃NO₂
• 分子量: 227.263
• InChiKey: HFDAZGAPCQRKEV-UHFFFAOYSA-N

物化性质

• 熔点：
  99-100 °C
• 沸点：
  414.1±35.0 °C(Predicted)
• 密度：
  1.172±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  5-benzoyl-2-methoxyaniline 在 一水合肼 、 zinc(II) chloride 作用下， 生成
  参考文献：
  名称：

  DE2903709

  摘要：

  公开号：
• 作为产物：
  描述：

  4-甲氧基-3-硝基苯甲酸 在 三氯化铝 、 草酰氯 、 铁粉 、 溶剂黄146 、 N,N-二甲基甲酰胺 作用下， 以 二氯甲烷 为溶剂， 反应 4.0h， 生成 5-benzoyl-2-methoxyaniline
  参考文献：
  名称：

  Utility of Complementary Molecular Reactivity and Molecular Recognition (CMR/R) Technology and Polymer-Supported Reagents in the Solution-Phase Synthesis of Heterocyclic Carboxamides

  摘要：

  The use of our recently reported chemical library purification strategy in the development of a herbicidal lead, N-(3-benzoylphenyl)-3-(1,1-dimethylethyl)-1-methyl-1H-pyrazole-5-carboxamide (3), is described. The approach applying fundamental properties of complementary molecular reactivity and molecular recognition (CMR/R) as the basis for a general purification strategy was utilized. Polymeric reagents were used in the synthesis to generate reactive species involved in product formation, and complementary molecular reactivity/molecular recognition polymer 8 (CMR/R polymer 8) was used in the solution-phase syntheses of building blocks, primary libraries, and lead refinement libraries. An extension of the CMR/R methodology was applied, utilizing a sequestration enabling reagent (SER), transforming a reactant into an electrophilic species sequestrable by CMR/R polymer 8. This library purification strategy enabled rapid lead generation and lead refinement to afford herbicide 27o. The CMR/R solid-phase purification technique enabled a simple, general, and powerful protocol, eliminating the usual tedious and time-consuming methods required for solution-phase product purification. The result was the synthesis of hundreds of compounds, prepared in a relatively short time, leading to a compound with a 4-fold improvement in herbicidal activity over the initial lead.

  DOI：

  10.1021/jo970571i

文献信息

• Photocatalytic C–H Amination of Aromatics Overcoming Redox Potential Limitations
  作者：Tatsuya Morofuji、Gun Ikarashi、Naokazu Kano

  DOI：10.1021/acs.orglett.0c00822

  日期：2020.4.3

  report the photocatalytic C–H amination of aromatics overcoming redox potential limitations. Radical cations of aromatic compounds are generated photocatalytically using Ru(phen)3(PF6)2, which has a reduction potential at a high oxidation state (Ered(RuIII/RuII) = +1.37 V vs SCE) lower than the oxidation potentials of aromatic substrates (Eox = +1.65 to +2.27 V vs SCE). The radical cations are trapped

  我们报道了克服氧化还原潜在限制的芳香族化合物的光催化C–H胺化反应。使用Ru（phen）3（PF 6）2光催化生成芳香族化合物的自由基阳离子，该Ru（phen）3（PF 6）2在高氧化态下的还原电势（E red（Ru III / Ru II）= +1.37 V vs SCE）低于三氧化二砷。芳香族底物的氧化电位（E ox = +1.65至+2.27 V vs SCE）。自由基阳离子被吡啶捕获，得到N-芳基吡啶鎓离子，该离子被转化为芳族胺。
• Non-linear optical device
  申请人：HITACHI, LTD.

  公开号：EP0315140A2

  公开（公告）日：1989-05-10

  According to the present invention, there is provided a non-linear optical device comprising a non-linear optical medium comprising an organic compound, which remarkably improves the non-linear optical properties. The non-linear optical device according to the present invention is suited for the second and third harmonic generations, photomixing optical parametric oscillations, optical switches and optical bistable devices.

  根据本发明，提供了一种非线性光学器件，它包括一种由有机化合物组成的非线性光学介质，可显著改善非线性光学特性。本发明的非线性光学器件适用于二次和三次谐波代、光混合光学参量振荡、光学开关和光学双稳态器件。
• HETEROBICYCLIC DERIVATIVES
  申请人：FUJISAWA PHARMACEUTICAL CO., LTD.

  公开号：EP0770079A1

  公开（公告）日：1997-05-02
• US4118384A
  申请人：——

  公开号：US4118384A

  公开（公告）日：1978-10-03
• US4285863A
  申请人：——

  公开号：US4285863A

  公开（公告）日：1981-08-25