1-(4-Tert-butylphenyl)-3-(4-methoxyphenyl)thioxanthen-9-one | 1313429-04-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 硫色烯
• 英文名称: 1-(4-Tert-butylphenyl)-3-(4-methoxyphenyl)thioxanthen-9-one
• 英文别名: 1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)thioxanthen-9-one
• CAS: 1313429-04-7
• 化学式: C₃₀H₂₆O₂S
• 分子量: 450.601
• InChiKey: MCKSCSKGGMGOFY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.4
• 重原子数：
  33
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  9-oxo-9H-thioxanthene-1,3-diyl bis(trifluoromethanesulfonate) 在 potassium phosphate 、 四(三苯基膦)钯 作用下， 以 四氢呋喃 、 1,4-二氧六环 为溶剂， 反应 14.0h， 生成 1-(4-Tert-butylphenyl)-3-(4-methoxyphenyl)thioxanthen-9-one
  参考文献：
  名称：

  Site-selective Suzuki–Miyaura reactions of the bis(triflate) of 1,3-dihydroxythioxanthone

  摘要：

  The palladium(0)-catalyzed Suzuki cross-coupling reaction of the bis(triflate) of 1,3-dihydroxythioxanthone afforded various aryl-substituted thioxanthones. The reactions proceeded with very good site-selectivity in favour of position 3, due to steric reasons. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.04.102

文献信息

• Site-selective Suzuki–Miyaura reactions of the bis(triflate) of 1,3-dihydroxythioxanthone
  作者：Dhafer Saber Zinad、Munawar Hussain、Omer Adeeb Akrawi、Alexander Villinger、Peter Langer

  DOI：10.1016/j.tetlet.2011.04.102

  日期：2011.7

  The palladium(0)-catalyzed Suzuki cross-coupling reaction of the bis(triflate) of 1,3-dihydroxythioxanthone afforded various aryl-substituted thioxanthones. The reactions proceeded with very good site-selectivity in favour of position 3, due to steric reasons. (C) 2011 Elsevier Ltd. All rights reserved.