3-(2-naphthyl)-3-methylcyclohexanone | 1227936-35-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 3-(2-naphthyl)-3-methylcyclohexanone
• 英文别名: 3-methyl-3-(2-naphthyl)cyclohexanone；3-Methyl-3-naphthalen-2-ylcyclohexan-1-one；3-methyl-3-naphthalen-2-ylcyclohexan-1-one
• CAS: 1227936-35-7
• 化学式: C₁₇H₁₈O
• 分子量: 238.329
• InChiKey: CKNQNVKBEOGTRE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  3-甲基-2-环己烯-1-酮 、 2-萘硼酸 在 2BF₄^(1-)*C₂₀H₂₂N₄O₂Pd₂⁽²⁺⁾ 作用下， 以 甲醇 为溶剂， 以61%的产率得到3-(2-naphthyl)-3-methylcyclohexanone
  参考文献：
  名称：

  Cationic Pd(II)/Bipyridine-Catalyzed Conjugate Addition of Arylboronic Acids to β,β-Disubstituted Enones: Construction of Quaternary Carbon Centers

  摘要：

  Cationic Pd(II)-catalyzed addition of arylboronic acids to beta,beta-disubstituted enones in high yields was developed. This method provided an efficient method for the construction of quaternary carbon centers, and only 0.5 mol % of Pd(II) catalyst was needed.

  DOI：

  10.1021/ol100767u

文献信息

• Cationic Pd(II)/Bipyridine-Catalyzed Conjugate Addition of Arylboronic Acids to β,β-Disubstituted Enones: Construction of Quaternary Carbon Centers
  作者：Shaohui Lin、Xiyan Lu

  DOI：10.1021/ol100767u

  日期：2010.6.4

  Cationic Pd(II)-catalyzed addition of arylboronic acids to beta,beta-disubstituted enones in high yields was developed. This method provided an efficient method for the construction of quaternary carbon centers, and only 0.5 mol % of Pd(II) catalyst was needed.