Pt(3-(quinolin-8-yl)thiophene(-1H))2 | 1278472-16-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: Pt(3-(quinolin-8-yl)thiophene(-1H))2
• 英文别名: platinum(2+);8-(2H-thiophen-2-id-3-yl)quinoline
• CAS: 1278472-16-4
• 化学式: C₂₆H₁₆N₂PtS₂
• 分子量: 615.638
• InChiKey: DLQYKRXOHVFKCO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.52
• 重原子数：
  31
• 可旋转键数：
  0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  76.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  8-(thiophen-3-yl)quinoline 以 四氢呋喃 、 苯 为溶剂， 生成 Pt(3-(quinolin-8-yl)thiophene(-1H))2
  参考文献：
  名称：

  C−H and C−S Activations of Quinoline-Functionalized Thiophenes by Platinum Complexes

  摘要：

  We synthesized and characterized two ligands, 2-(quinolin-8-yl)thiophene (1a) and 3-(quinolin-8-yl)thiophene (1b). The selective C-H activation of the thiophene moieties was achieved by reacting 1a or, 1b and [Pt(CH3)(2)(SMe2)](2). We observed eta(2)-thiophene intermediates during the course of the reactions. The selective C-S bond activation of the thiophene moieties was observed after reacting 1a or 1b and [Pt(dippe)H](2). DFT calculations were performed to elucidate the regioselectivity of C-S activations.

  DOI：

  10.1021/om101171s