4-(p-tolylamino)pentan-2-one | 1422578-07-1

• 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: 4-(p-tolylamino)pentan-2-one
• 英文别名: 4-(4-Methylanilino)pentan-2-one；4-(4-methylanilino)pentan-2-one
• CAS: 1422578-07-1
• 化学式: C₁₂H₁₇NO
• 分子量: 191.273
• InChiKey: MCZGHJQRXCFURN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  29.1
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-(p-methylphenylamino)propanoic acid 、 丙酮 在 L-脯氨酸 、 荧光素 作用下， 反应 24.0h， 以82%的产率得到4-(p-tolylamino)pentan-2-one
  参考文献：
  名称：

  Amphiphilic methyleneamino synthon through organic dye catalyzed-decarboxylative aminoalkylation

  摘要：

  揭示了一种利用由有机染料和可见光辐射生成的N-苯基甘氨酸的光诱导合成体。该中间体可以通过简单的操作与自由基或亲核试剂偶联，生成几种类似天然产物的化合物。

  DOI：

  10.1039/c3ob41091a

文献信息

• Heterobimetallic Pd–Sn Catalysis: Michael Addition Reaction with C-, N-, O-, and S-Nucleophiles and in Situ Diagnostics
  作者：Debjit Das、Sanjay Pratihar、Sujit Roy

  DOI：10.1021/jo302643v

  日期：2013.3.15

  An efficient Michael addition reaction of differently substituted enones with carbon, sulfur, oxygen, and nitrogen nucleophiles has been achieved by a new heterobimetallic "Pd-Sn" catalyst system. The nature of the catalytically relevant species and their interactions with the enone moiety has been examined by spectroscopy. The effect of ligand and the coordination mode of enone with "Pd-Sn" heterobimetallic system have been investigated by kinetics and DFT studies. A straightforward application of this methodology is shown in the synthesis of 1,4-oxathiepane core.
• Amphiphilic methyleneamino synthon through organic dye catalyzed-decarboxylative aminoalkylation
  作者：Li Chen、Chin Sheng Chao、Yuanhang Pan、Sheng Dong、Yew Chin Teo、Jian Wang、Choon-Hong Tan

  DOI：10.1039/c3ob41091a

  日期：——

  The utilization of a photo-induced synthon generated from N-phenyl glycine by an organic dye and visible light irradiation is disclosed. The intermediate could be coupled with either a radical or a nucleophile in a simple operation to afford several natural product-like compounds.

  揭示了一种利用由有机染料和可见光辐射生成的N-苯基甘氨酸的光诱导合成体。该中间体可以通过简单的操作与自由基或亲核试剂偶联，生成几种类似天然产物的化合物。