2-formylnaphthalen-1-yl 4-methylbenzoate | 940087-45-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-formylnaphthalen-1-yl 4-methylbenzoate
• 英文别名: (2-Formylnaphthalen-1-yl) 4-methylbenzoate
• CAS: 940087-45-6
• 化学式: C₁₉H₁₄O₃
• 分子量: 290.318
• InChiKey: SRTUZTKVTPMMGQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  对二甲苯 、 2-羟基-1-萘甲醛 在 叔丁基过氧化氢 、 copper(II) acetate monohydrate 作用下， 以 癸烷 为溶剂， 反应 3.5h， 以62%的产率得到2-formylnaphthalen-1-yl 4-methylbenzoate
  参考文献：
  名称：

  Directing Group Assisted Copper-Catalyzed Chemoselective O-Aroylation of Phenols and Enols Using Alkylbenzenes

  摘要：

  By using alkylbenzenes as aroyl surrogates, copper(II) catalyzed chemoselective O-aroylations of 1,3-dicarbonyl compounds and phenolic -OH ortho to carbonyl (-CHO, -COR) groups have been achieved. A dual mechanism operating in tandem for these transformations has been supported by a crossover experiment.

  DOI：

  10.1021/ol401682a

文献信息

• Directing Group Assisted Copper-Catalyzed Chemoselective <i>O</i>-Aroylation of Phenols and Enols Using Alkylbenzenes
  作者：Saroj Kumar Rout、Srimanta Guin、Arghya Banerjee、Nilufa Khatun、Anupal Gogoi、Bhisma K. Patel

  DOI：10.1021/ol401682a

  日期：2013.8.16

  By using alkylbenzenes as aroyl surrogates, copper(II) catalyzed chemoselective O-aroylations of 1,3-dicarbonyl compounds and phenolic -OH ortho to carbonyl (-CHO, -COR) groups have been achieved. A dual mechanism operating in tandem for these transformations has been supported by a crossover experiment.