2,2'-((4-(dimethylamino)phenyl)methylene)dicyclohexane-1,3-dione | 144284-91-3

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 2,2'-((4-(dimethylamino)phenyl)methylene)dicyclohexane-1,3-dione
• 英文别名: 2,2'-(4-dimethylamino-benzylidene)-bis-cyclohexane-1,3-dione；2,2'-(4-Dimethylamino-benzyliden)-bis-cyclohexan-1,3-dion；Bis-(2.6-dioxo-cyclohexyl)-(4-dimethylamino-phenyl)-methan；2-[[4-(dimethylamino)phenyl]-(2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione
• CAS: 144284-91-3
• 化学式: C₂₁H₂₅NO₄
• 分子量: 355.434
• InChiKey: MSGKOYXFPREUDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.71
• 重原子数：
  26.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  71.52
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  对二甲氨基苯甲醛 生成 2,2'-((4-(dimethylamino)phenyl)methylene)dicyclohexane-1,3-dione
  参考文献：
  名称：

  276.环六-1：3-二酮的制备：对醛的表征的试剂

  摘要：

  DOI：

  10.1039/jr9480001371

文献信息

• Synthesis of tetraketones in water and under catalyst-free conditions
  作者：Jian-Jun Yu、Li-Min Wang、Jin-Qian Liu、Feng-Lou Guo、Ying Liu、Ning Jiao

  DOI：10.1039/b913816a

  日期：——

  A simple, environmentally friendly, tandem Knoevenagel condensation and Michael addition procedure is reported. The reactions between cyclic-13-diketones and a variety of aldehydes were carried out in water to afford tetraketones (64–99%). In this green synthetic protocol, the solvent water itself catalysed the reaction by hydrogen bonding, thus avoiding the use of any other catalysts to make the work up procedure easier.

  报告采用了一种简单、环保的串联克诺文纳格尔缩合和迈克尔加成程序。环-13-二酮类化合物与多种醛类化合物在水中发生反应，生成四酮类化合物（64-99%）。在这一绿色合成方案中，溶剂水本身通过氢键催化反应，从而避免了使用任何其他催化剂，使合成过程更加简便。
• New aspects in the reaction of azomethines with cyclic CH-acidic compounds
  作者：Lothar Hennig、Mario Alva-Astudillo、Gerhard Mann、Thomas Kappe

  DOI：10.1007/bf00816851

  日期：——

  Treatment of substituted benzylidene anilines 1 a - f with cyclic CH-acidic compounds 2 a - m in ethanol at room temperature yields in additon/elimination reactions the corresponding arylidene derivatives 4 and the 2 : 1 adducts 5. The addition products 3, which are formed as intermediates, could not be isolated in any case. The donor/acceptor effect of the substituents on the benzylidene moiety influences to a significant extent the reactivity towards the azomethine carbon.