[[amino-(4-methoxyphenyl)methylidene]amino] benzoate | 68451-74-1

• 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: [[amino-(4-methoxyphenyl)methylidene]amino] benzoate
• CAS: 68451-74-1
• 化学式: C₁₅H₁₄N₂O₃
• 分子量: 270.288
• InChiKey: ACNPGUCGSCFEHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.17
• 重原子数：
  20.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  73.91
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  [[amino-(4-methoxyphenyl)methylidene]amino] benzoate 以 N,N-二甲基甲酰胺 为溶剂， 200.0 ℃ 、900.01 kPa 条件下， 反应 0.17h， 以46 mg的产率得到3-(4-methoxyphenyl)-5-phenyl-1,2,4-oxadiazole
  参考文献：
  名称：

  Rapid Multistep Synthesis of 1,2,4-Oxadiazoles in a Single Continuous Microreactor Sequence

  摘要：

  A general method for the synthesis of bis-substituted 1,2,4-oxadiazoles from readily available aryinitriles and activated carbonyls in a single continuous microreactor sequence is described. The synthesis incorporates three sequential microreactors to produce 1,2,4-oxadiazoles in similar to 30 min in quantities (40-80 mg) sufficient for full characterization and rapid library supply.

  DOI：

  10.1021/jo801152c
• 作为产物：
  描述：

  4-甲氧基苄胺肟 、 苯甲酰氯 以 N,N-二甲基甲酰胺 为溶剂， 生成 [[amino-(4-methoxyphenyl)methylidene]amino] benzoate
  参考文献：
  名称：

  Rapid Multistep Synthesis of 1,2,4-Oxadiazoles in a Single Continuous Microreactor Sequence

  摘要：

  A general method for the synthesis of bis-substituted 1,2,4-oxadiazoles from readily available aryinitriles and activated carbonyls in a single continuous microreactor sequence is described. The synthesis incorporates three sequential microreactors to produce 1,2,4-oxadiazoles in similar to 30 min in quantities (40-80 mg) sufficient for full characterization and rapid library supply.

  DOI：

  10.1021/jo801152c

文献信息

• Miller, Chemische Berichte, 1889, vol. 22, p. 2794
  作者：Miller

  DOI：——

  日期：——
• Grambal, Frantisek; Lasovsky, Jan, Collection of Czechoslovak Chemical Communications, 1986, vol. 51, # 12, p. 2786 - 2797
  作者：Grambal, Frantisek、Lasovsky, Jan

  DOI：——

  日期：——
• Grambal, Frantisek; Lasovsky, Jan, Collection of Czechoslovak Chemical Communications, 1985, vol. 50, # 12, p. 2722 - 2729
  作者：Grambal, Frantisek、Lasovsky, Jan

  DOI：——

  日期：——
• Kinetics and mechanism of the reaction of substitutedO-benzoylbenzamidoximes with sodium methoxide in methanol
  作者：Libor Dušek、Jaromír Kaválek、Vojeslav Štěrba

  DOI：10.1002/(sici)1099-1395(199908)12:8<626::aid-poc173>3.0.co;2-w

  日期：1999.8
• BELENKII, L. I.;BROKHOVETSKII, D. B.;KRAYUSHKIN, M. M., TETRAHEDRON, 46,(1990) N, C. 1659-1668
  作者：BELENKII, L. I.、BROKHOVETSKII, D. B.、KRAYUSHKIN, M. M.

  DOI：——

  日期：——