methyl 4-(1,1-dimethylethylsulfinamido)-2-methoxybenzoate | 1338209-73-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: methyl 4-(1,1-dimethylethylsulfinamido)-2-methoxybenzoate
• 英文别名: Methyl 4-(tert-butylsulfinylamino)-2-methoxybenzoate；methyl 4-(tert-butylsulfinylamino)-2-methoxybenzoate
• CAS: 1338209-73-6
• 化学式: C₁₃H₁₉NO₄S
• 分子量: 285.364
• InChiKey: NJQDWNKSTDYSBC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  83.8
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  4-溴-2-甲氧基苯甲酸甲酯 、 叔丁基亚磺酰胺 在 palladium diacetate 、 caesium carbonate 、 4,5-双二苯基膦-9,9-二甲基氧杂蒽 作用下， 以 1,4-二氧六环 为溶剂， 反应 15.0h， 以96%的产率得到methyl 4-(1,1-dimethylethylsulfinamido)-2-methoxybenzoate
  参考文献：
  名称：

  Efficient indoles and anilines syntheses employing tert-butyl sulfinamide as ammonia surrogate

  摘要：

  tert-Butyl sulfinamide is an ammonia equivalent for the palladium-catalyzed amination of aryl bromides and aryl chlorides. Using these amine derivatives, it has been observed that indoles and anilines with sensitive functional groups can be readily prepared. This surrogate has also been used for the synthesis of indoles from 2-halophenols using palladium catalyzed cross coupling reaction as the key step. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.08.075

文献信息

• Efficient indoles and anilines syntheses employing tert-butyl sulfinamide as ammonia surrogate
  作者：Anjanappa Prakash、Mullick Dibakar、Kumaravel Selvakumar、Kandasamy Ruckmani、Manickam Sivakumar

  DOI：10.1016/j.tetlet.2011.08.075

  日期：2011.10

  tert-Butyl sulfinamide is an ammonia equivalent for the palladium-catalyzed amination of aryl bromides and aryl chlorides. Using these amine derivatives, it has been observed that indoles and anilines with sensitive functional groups can be readily prepared. This surrogate has also been used for the synthesis of indoles from 2-halophenols using palladium catalyzed cross coupling reaction as the key step. (C) 2011 Elsevier Ltd. All rights reserved.