1-(4-Bromoanilino)cyclohexane-1-carboxylic acid | 1183790-67-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 1-(4-Bromoanilino)cyclohexane-1-carboxylic acid
• CAS: 1183790-67-1
• 化学式: C₁₃H₁₆BrNO₂
• 分子量: 298.18
• InChiKey: YYCSJCQCXCDQJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  氯仿 、 环己酮 、 4-溴苯胺 在 40% potassium fluoride/alumina 作用下， 以 甲苯 为溶剂， 以65%的产率得到1-(4-Bromoanilino)cyclohexane-1-carboxylic acid
  参考文献：
  名称：

  KF-alumina-mediated Bargellini reaction

  摘要：

  KF-alumina was found to be an efficient base for the synthesis of sterically hindered alpha-substituted carboxylic acids. A series of Bargellini reactions were performed by using various substituted anilines, phenols, and thiophenols as nucleophiles with ketones in the presence of chloroform and KF-alumina as a base. All the compounds were fully characterized. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.07.029

文献信息

• KF-alumina-mediated Bargellini reaction
  作者：Md. Rumum Rohman、Bekington Myrboh

  DOI：10.1016/j.tetlet.2010.07.029

  日期：2010.9

  KF-alumina was found to be an efficient base for the synthesis of sterically hindered alpha-substituted carboxylic acids. A series of Bargellini reactions were performed by using various substituted anilines, phenols, and thiophenols as nucleophiles with ketones in the presence of chloroform and KF-alumina as a base. All the compounds were fully characterized. (C) 2010 Elsevier Ltd. All rights reserved.