3-chloro-5-hydroxy-4-(naphthalen-1-ylsulfonyl)furan-2(5H)-one | 1610693-05-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 3-chloro-5-hydroxy-4-(naphthalen-1-ylsulfonyl)furan-2(5H)-one
• 英文别名: 3-Chloro-5-hydroxy-4-(naphthalen-1-ylsulfonyl)-furan-2(5h)-one；4-chloro-2-hydroxy-3-naphthalen-1-ylsulfonyl-2H-furan-5-one
• CAS: 1610693-05-4
• 化学式: C₁₄H₉ClO₅S
• 分子量: 324.741
• InChiKey: DCDBZTMPFPEOIZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  21
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  89
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  1-奈硫酚 在 双氧水 、 三乙胺 作用下， 以 乙醚 、 水 、 溶剂黄146 为溶剂， 反应 96.0h， 生成 3-chloro-5-hydroxy-4-(naphthalen-1-ylsulfonyl)furan-2(5H)-one
  参考文献：
  名称：

  Sulfides, sulfones, and sulfoxides of the furan-2(5H)-one series. synthesis and structure

  摘要：

  A number of 4- and 5-R-sulfanylfuran-2(5H)-one derivatives were synthesized, and their oxidation with various reagents was studied. The corresponding sulfones were obtained using hydrogen peroxide in acetic acid. 4-R-sulfanyl derivatives were selectively oxidized to sulfoxides with m-chloroperoxybenzoic acid. The molecular and crystal structures of some new sulfones and sulfoxides were determined by X-ray analysis.

  DOI：

  10.1134/s1070428014040149