3-(4-Methoxyphenyl)-4-(4-methoxyphenyl)sulfanylcyclobut-3-ene-1,2-dione | 956110-81-9

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 3-(4-Methoxyphenyl)-4-(4-methoxyphenyl)sulfanylcyclobut-3-ene-1,2-dione
• 英文别名: 3-(4-methoxyphenyl)-4-(4-methoxyphenyl)sulfanylcyclobut-3-ene-1,2-dione
• CAS: 956110-81-9
• 化学式: C₁₈H₁₄O₄S
• 分子量: 326.373
• InChiKey: VSDLKVMRGNZCSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  77.9
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  3-(4-Methoxyphenyl)-4-(4-methoxyphenyl)sulfanylcyclobut-3-ene-1,2-dione 在 palladium diacetate 、 tris(dibenzylideneacetone)dipalladium (0) 三(2-呋喃基)膦 、 四丁基溴化铵 、 sodium carbonate 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 反应 21.0h， 生成
  参考文献：
  名称：

  Selective Cross-Couplings. Sequential Stille−Liebeskind/Srogl Reactions of 3-Chloro-4-arylthiocyclobutene-1,2-dione

  摘要：

  The synthesis and initial reactivity studies of 2 are described. It was found that it participates in Stille couplings exclusively at the C-Cl site with a number of organostannanes (58-71% yield) in the absence of Cu(I). Then, these new derivatives were functionalized at the C-S site with boronic acids by switching to the Liebeskind-Srogi reaction conditions (in the presence of a Cu(l) carboxylate) to yield the bifunctionalized cyclobutenediones (44-90% yield).

  DOI：

  10.1021/ol701628z
• 作为产物：
  描述：

  4-甲氧基苯硫酚 在 双(乙腈)氯化钯(II) copper(l) iodide 、 三乙胺 作用下， 以 四氢呋喃 、 乙腈 为溶剂， 反应 7.0h， 生成 3-(4-Methoxyphenyl)-4-(4-methoxyphenyl)sulfanylcyclobut-3-ene-1,2-dione
  参考文献：
  名称：

  Selective Cross-Couplings. Sequential Stille−Liebeskind/Srogl Reactions of 3-Chloro-4-arylthiocyclobutene-1,2-dione

  摘要：

  The synthesis and initial reactivity studies of 2 are described. It was found that it participates in Stille couplings exclusively at the C-Cl site with a number of organostannanes (58-71% yield) in the absence of Cu(I). Then, these new derivatives were functionalized at the C-S site with boronic acids by switching to the Liebeskind-Srogi reaction conditions (in the presence of a Cu(l) carboxylate) to yield the bifunctionalized cyclobutenediones (44-90% yield).

  DOI：

  10.1021/ol701628z

文献信息

• Selective Cross-Couplings. Sequential Stille−Liebeskind/Srogl Reactions of 3-Chloro-4-arylthiocyclobutene-1,2-dione
  作者：Angélica Aguilar-Aguilar、Eduardo Peña-Cabrera

  DOI：10.1021/ol701628z

  日期：2007.10.1

  The synthesis and initial reactivity studies of 2 are described. It was found that it participates in Stille couplings exclusively at the C-Cl site with a number of organostannanes (58-71% yield) in the absence of Cu(I). Then, these new derivatives were functionalized at the C-S site with boronic acids by switching to the Liebeskind-Srogi reaction conditions (in the presence of a Cu(l) carboxylate) to yield the bifunctionalized cyclobutenediones (44-90% yield).