5,7-dimethyl-7-neopentyl-5H-[1,3]dioxolo[4,5-f]indol-6(7H)-one | 1382847-37-1

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: 5,7-dimethyl-7-neopentyl-5H-[1,3]dioxolo[4,5-f]indol-6(7H)-one
• CAS: 1382847-37-1
• 化学式: C₁₆H₂₁NO₃
• 分子量: 275.348
• InChiKey: RFNQPYCKUBYBBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.09
• 重原子数：
  20.0
• 可旋转键数：
  1.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  38.77
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  N-(benzo[d][1,3]dioxol-5-yl)-N-methylmethacrylamide 、 二(叔丁基羰基氧基)碘苯 在 新铜试剂 、 cesium pivalate 、 calcium carbonate 作用下， 以 N,N-二甲基乙酰胺 为溶剂， 反应 24.0h， 生成 6,8-dimethyl-6-neopentyl-6H-[1,3]dioxolo[4,5-g]indol-7(8H)-one 、 5,7-dimethyl-7-neopentyl-5H-[1,3]dioxolo[4,5-f]indol-6(7H)-one
  参考文献：
  名称：

  Organocatalyzed arylalkylation of activated alkenes via decarboxylation of PhI(O2CR)2: efficient synthesis of oxindoles

  摘要：

  A novel organocatalyzed arylalkylation of activated alkenes has been developed. This reaction was initiated from the decomposition of PhI(O2CR)(2) to generate alkyl radical, followed by addition to alkenes. Then the formed radical was trapped by aromatic ring to generate the cyclized products. This method presents an efficient road to synthesis of a variety of oxindoles. Crown Copyright (C) 2012 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.03.051