N-[4-hydroxy-3-(phenylsulfonyl)phenyl]methanesulfonamide | 1369434-09-2

• 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: N-[4-hydroxy-3-(phenylsulfonyl)phenyl]methanesulfonamide
• 英文别名: N-[4-hydroxy-3-(phenylsulfonyl)phenyl]methane-sulfonamide；N-[3-(benzenesulfonyl)-4-hydroxyphenyl]methanesulfonamide
• CAS: 1369434-09-2
• 化学式: C₁₃H₁₃NO₅S₂
• 分子量: 327.382
• InChiKey: MCUOUYXIGZVSNS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  117
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  N-(4-oxocyclohexa-2,5-dien-1-ylidene)methanesulfonamide 、 sodium benzenesulfonate 在 溶剂黄146 作用下， 以78%的产率得到N-[4-hydroxy-3-(phenylsulfonyl)phenyl]methanesulfonamide
  参考文献：
  名称：

  Reactions of N-aryl(methyl, trifluoromethyl)sulfonyl-1,4-benzoquinone monoimines with sodium sulfinates

  摘要：

  In reactions with sodium sulfinates of N-substituted 1,4-benzoquinone monoimines with the quinoid ring having free positions 2 and/or 6 the fraction of products of 1,4-addition of the sulfinate ion grows in the series ArSO2 -> MeSO2 -> CF3SO2. In the case of 2,6-dimethyl derivatives the 1,6-addition is preferable, and the amount of products of 6,1-addition decreases.

  DOI：

  10.1134/s107042801202011x

文献信息

• Reactions of N-aryl(methyl, trifluoromethyl)sulfonyl-1,4-benzoquinone monoimines with sodium sulfinates
  作者：A. P. Avdeenko、S. A. Konovalova、O. N. Mikhailichenko、S. V. Shelyazhenko、V. V. Pirozhenko、L. M. Yagupol’skii

  DOI：10.1134/s107042801202011x

  日期：2012.2

  In reactions with sodium sulfinates of N-substituted 1,4-benzoquinone monoimines with the quinoid ring having free positions 2 and/or 6 the fraction of products of 1,4-addition of the sulfinate ion grows in the series ArSO2 -> MeSO2 -> CF3SO2. In the case of 2,6-dimethyl derivatives the 1,6-addition is preferable, and the amount of products of 6,1-addition decreases.