4-Benzyl-6-methyl coumarin

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 4-Benzyl-6-methyl coumarin
• 英文别名: 4-benzyl-6-methyl-coumarin；4-Benzyl-6-methyl-cumarin；4-Benzyl-6-methylchromen-2-one
• 化学式: C₁₇H₁₄O₂
• 分子量: 250.297
• InChiKey: UAZPNNAXTHERJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-Phenyl-2'-methoxy-5'-methyl-acetophenon 在 氢碘酸 、 锌 、 苯 作用下， 生成 4-Benzyl-6-methyl coumarin
  参考文献：
  名称：

  Chakravarti; Bera, Journal of the Indian Chemical Society, 1944, vol. 21, p. 44

  摘要：

  DOI：

文献信息

• [Pd(PPh3)2(saccharinate)2]—general catalyst for Suzuki–Miyaura, Negishi cross-coupling and C–H bond functionalization of coumaryl and pyrone substrates
  作者：Parin Shah、M. Dolores Santana、Joaquín García、J. Luis Serrano、Minal Naik、Suhas Pednekar、Anant R. Kapdi

  DOI：10.1016/j.tet.2012.12.030

  日期：2013.2

  The potential of complex [Pd(PPh3)(2)(saccharinate)(2)] 1 in catalyzing Suzuki-Miyaura cross-coupling of 4-halo and 4-bromomethyl coumaryl and pyrone substrates with different aryl boronic acids has been explored. Excellent yields of the desired products are obtained in competitive reaction time and under relatively mild conditions. Negishi cross-coupling of 4-coumaryl tosylate with aryl and allcylzinc reagents has also been performed with good yields of the cross-coupled products obtained in most cases. Intramolecular C-H bond functionalization of coumaryl ethers also furnished very high yields of synthetically attractive tetracyclic ring systems exhibiting the potential of I as a powerful catalyst in synthetically important reactions. (C) 2012 Elsevier Ltd. All rights reserved.
• Chakravarti; Bera, Journal of the Indian Chemical Society, 1944, vol. 21, p. 44
  作者：Chakravarti、Bera

  DOI：——

  日期：——