3,3,6,6-tetramethyl-9-(4-bromophenyl)-10-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione | 404921-33-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 3,3,6,6-tetramethyl-9-(4-bromophenyl)-10-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
• 英文别名: 9-(4-bromophenyl)-10-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-2H,5H-acridine-1,8-dione；9-(4-bromophenyl)-10-(4-methoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione
• CAS: 404921-33-1
• 化学式: C₃₀H₃₂BrNO₃
• 分子量: 534.493
• InChiKey: JOZVHGRYNZIJQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  35
• 可旋转键数：
  3
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  46.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N-(4-bromobenzylidene)-4-methoxyaniline 、 5,5-二甲基-1,3-环己二酮 在 1-丁基-3-甲基咪唑溴盐 作用下， 生成 3,3,6,6-tetramethyl-9-(4-bromophenyl)-10-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
  参考文献：
  名称：

  醛，胺和二甲酮在离子液体中的三组分反应有效合成多氢ac啶衍生物

  摘要：

  本文制备了3,3,6,6-四甲基-9,10-二芳基-1,2,3,4,5,6,7,8,9,10-十氢ac啶-1,8-二酮衍生物描述了由醛，芳族胺和5，5-二甲基-1，3-环己二酮在1-正丁基-3-甲基咪唑鎓溴化物（[bmim] Br）中的组成。这些化合物的结构通过元素分析，IR和1 H NMR光谱进行表征，并通过单晶X射线衍射分析进一步证实。

  DOI：

  10.1002/jhet.5570450303

文献信息

• The synthesis of new 8-imino-1-one acridine derivatives catalyzed by a calix[4]arene mono-acid core
  作者：Piyali Sarkar、Chhanda Mukhopadhyay

  DOI：10.1039/c6gc02144a

  日期：——

  Mono-acid incorporated calix[4]arene has been successfully established as the catalyst for the synthesis of 8-imino-1-one acridine derivatives obtained by the condensation of enaminoketones and aldehydes (2:1 ratio). In this paper,...

  单酸结合的杯[4]芳烃已成功地建立为用于合成8-亚氨基-1-酮a啶衍生物的催化剂，所述derivatives啶酮是通过烯胺酮和醛的缩合（比例为2：1）而获得的。在本文中，...
• Immobilization of organofunctionalized silica (SiMPTMS) with biphenyl-2,2′-dioic acid and investigation of its catalytic property for one-pot tandem synthesis of acridine-1,8-dione derivatives
  作者：Rupali Vaid、Monika Gupta、Vivek K. Gupta

  DOI：10.1007/s13738-017-1156-3

  日期：2017.10

  3-cyclohexanedione with various aldehydes. This method results in the synthesis of high-yielding acridine-1,8-dione derivatives and also provides simple and facile recyclability of the catalyst. The synthesized derivatives were characterized by IR, 1H-NMR, 13C-NMR and mass spectroscopy. Molecular structures of three acridine-1,8-dione derivatives were determined by single-crystal X-ray diffraction which determines

  摘要通过FTIR，TGA，TEM和SEM等多种光谱技术，合成并固定了MPTMS-官能化的固定有联苯-2,2'-二酸的二氧化硅。已经证明了合成催化剂对芳族胺和5，5-二甲基-1，3-环己二酮与各种醛的一锅法Knoevenagel / Michael缩合反应。该方法导致高产率的a啶-1，8-二酮衍生物的合成，并且还提供了催化剂的简单和容易的再循环性。合成的衍生物经IR，1 H-NMR，13表征。13 C-NMR和质谱。通过单晶X射线衍射确定三种three啶-1,8-二酮衍生物的分子结构，该晶体确定3,3,6,6-四甲基-9,10-二苯基-1,8-二氧代十二烷基氢化ca啶在单斜晶中结晶。具有空间组P2 1 / c的3,3,6,6-四甲基-9-（4-氯苯基）-10-（4-甲基苯基）-1,8-二氧十二烷基氢化hydro啶在具有空间组P2 1 / n的单斜晶体中结晶3,3,6,6-四甲基-9-（4-氯苯基）-10-（4-甲氧基苯基）-1
• Three-Component One-Pot Synthesis of Polyhydroacrodine Derivatives in Aqueous Media
  作者：Da-Qing Shi、Jing-Wen Shi、Hao Yao

  DOI：10.1080/00397910802431057

  日期：2009.1.28

  Abstract 9,10-Diaryldecahydroacridine-1,8-diones were synthesized by a three-component reaction of aromatic aldehydes, aromatic amines, and 5,5-dimethyl-1,3-cyclohexanedione using sodium 1-dodecanesulfonic (SDS) as the catalyst in aqueous media. The key intermediates before the cyclization step were obtained and characterized. The structures of all the products were determined by IR and 1H NMR spectra

  摘要 以 1-十二烷磺酸钠 (SDS) 为催化剂，通过芳香醛、芳香胺和 5,5-二甲基-1,3-环己二酮的三组分反应合成了 9,10-二芳基十氢吖啶-1,8-二酮。在水介质中。获得并表征了环化步骤之前的关键中间体。所有产物的结构均通过 IR 和 1H NMR 光谱确定，并通过单晶 X 射线衍射分析进一步证实。
• An efficient synthesis of polyhydroacridine derivatives by the three-component reaction of aldehydes, amines and dimedone in ionic liquid
  作者：Da-Qing Shi、Sai-Nan Ni、Fang-Yang、Jing-Wen Shi、Guo-Lan Dou、Xiao-Yue Li、Xiang-Shan Wang

  DOI：10.1002/jhet.5570450303

  日期：2008.5

  In this paper the preparation of 3,3,6,6-tetramethyl-9,10-diaryl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione derivatives from aldehydes, aromatic amines and 5,5-dimethyl-1,3-cyclohexanedione in 1-n-butyl-3-methylimidazolium bromide ([bmim]Br) is described. The structures of these compounds were characterized by elemental analysis, IR and 1H NMR spectra and further confirmed by single crystal X-ray

  本文制备了3,3,6,6-四甲基-9,10-二芳基-1,2,3,4,5,6,7,8,9,10-十氢ac啶-1,8-二酮衍生物描述了由醛，芳族胺和5，5-二甲基-1，3-环己二酮在1-正丁基-3-甲基咪唑鎓溴化物（[bmim] Br）中的组成。这些化合物的结构通过元素分析，IR和1 H NMR光谱进行表征，并通过单晶X射线衍射分析进一步证实。