3-(4-(diphenylamino)phenyl)-1-phenylprop-2-en-1-one

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 3-(4-(diphenylamino)phenyl)-1-phenylprop-2-en-1-one
• 英文别名: (E)-4-(diphenylamino)chalcone；3-(4-Diphenylamino-phenyl)-1-phenyl-propenone；(E)-1-phenyl-3-[4-(N-phenylanilino)phenyl]prop-2-en-1-one
• 化学式: C₂₇H₂₁NO
• 分子量: 375.47
• InChiKey: JBHFXWSEIGJYKW-DYTRJAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-(4-(diphenylamino)phenyl)-1-phenylprop-2-en-1-one 、 2-肼基苯并噻唑 在 盐酸 作用下， 以 乙醇 、 水 为溶剂， 以66%的产率得到1-(benzothiazol-2-yl)-3-phenyl-5-(diphenylamino)phenyl-2-pyrazoline
  参考文献：
  名称：

  The synthesis and characterisation of novel pyrazoline derivatives containing triphenylamine

  摘要：

  Novel pyrazoline optical materials were synthesized and characterized using H-1, C-13 NMR and HRMS: the thermal, optical and electrochemical properties of the compounds were also investigated. Solvent effects on the fluorescence of the six compounds indicated that the emission wavelength was red-shifted with increase in solvent polarity. Quantum chemical calculations were used to obtain optimized ground-state geometry as well as spatial distributions of the highest occupied molecular orbital (HOMO) and the lowest unoccupied molecular orbital (LUMO) levels of the compounds. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2009.11.004
• 作为产物：
  描述：

  3-苯甲酰丙烯酸 、 4-硼酸三苯胺 在 palladium diacetate 、 copper(II) acetate monohydrate 、 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以79%的产率得到3-(4-(diphenylamino)phenyl)-1-phenylprop-2-en-1-one
  参考文献：
  名称：

  Palladium-Catalyzed Decarboxylative Arylation of Benzoylacrylic Acids toward the Synthesis of Chalcones

  摘要：

  It has been found that readily available 3-benzoylacrylic acids undergo palladium-catalyzed decarboxylative arylation with arylboronic acids in the presence of a copper salt oxidant to produce chalcone derivatives. The decarboxylative arylation could also be achieved using aryl halides as the alternative aryl source to expand the applicable scope.

  DOI：

  10.1021/jo400716e

文献信息

• Nickel-Catalyzed Enantioselective Reductive Conjugate Arylation and Heteroarylation via an Elementary Mechanism of 1,4-Addition
  作者：Luoqiang Zhang、Mengxin Zhao、Maoping Pu、Zhaoming Ma、Jingsong Zhou、Caiyou Chen、Yun-Dong Wu、Yonggui Robin Chi、Jianrong Steve Zhou

  DOI：10.1021/jacs.2c05678

  日期：2022.11.9

  A nickel complex of isoquinox promoted enantioselective conjugate arylation and heteroarylation of enones using aryl and heteroaryl halides directly. The reaction was successfully applied to stereoselective syntheses of ar-turmerone, chiral fragments of (+)-tolterodine and AZD5672. Mechanistically, experiments and calculations supported that an arylnickel(I) complex inserted to enones via an elementary

  异喹诺酮的镍络合物直接使用芳基和杂芳基卤化物促进烯酮的对映选择性共轭芳基化和杂芳基化。该反应成功应用于ar -turmerone、(+)-tolterodine和AZD5672手性片段的立体选择性合成。从机理上讲，实验和计算支持芳基镍 (I) 络合物通过基本 1,4-加成插入到烯酮中。
• Photoconductive layers containing a mixture of at least two different organic photoconductors and electrophotographic elements comprising said layers
  申请人：EASTMAN KODAK COMPANY (a New Jersey corporation)

  公开号：EP0011980A1

  公开（公告）日：1980-06-11

  The problem of crystallization of organic photoconductive compounds in insulating binder-containing layers, which may impair the capability of those layers to produce high- resolution images, is overcome by using as the photoconductor a mixture comprising at least two compounds of the formula: wherein R is an alkyl, substituted alkyl, aralkyl, aryl or substituted aryl group; each of X, X', Y, and Y', which may be the same or different, is hydrogen, alkyl, substituted alkyl, alkoxy, substituted alkoxy, hydroxyl, nitro or halogen; each of A and 8, which may be the same or different, is hydrogen, alkyl, substituted alkyl, alkoxy, substituted alkoxy, hydroxyl, halogen, unsubstituted or substituted aryl, cycloalkyl having four to ten carbon atoms and cycloalkenyl having four to eight carbon atoms; or A and B taken together represent atoms which form with the carbon to which they are attached a substituted or unsubstituted carbocyclic ring having from 4 to 10 atoms, any alkyl, substituted alkyl, alkoxy or substituted alkoxy substituent having from 1 to 10 carbon atoms and any aryl or substituted aryl group being an unsubstituted or substituted phenyl, naphthyl or anthryl group, any substituent in a substituted aryl group being an amino, alkylamino, or dialkylamino group or a substituent as defined for X, X', Y and Y'.

  有机光电导化合物在含绝缘粘合剂的层中结晶，可能会影响这些层产生高分辨率图像的能力，这一问题可通过使用至少由两种式化合物组成的混合物作为光电导体来解决： 其中 R 是烷基、取代烷基、芳基、芳基或取代芳基； X、X'、Y 和 Y'（可以相同或不同）各自是氢、烷基、取代烷基、烷氧基、取代烷氧基、羟基、硝基或卤素； A 和 8（可以相同或不同）各自是氢、烷基、取代的烷基、烷氧基、取代的烷氧基、羟基、卤素、未取代或取代的芳基、具有四至十个碳原子的环烷基和具有四至八个碳原子的环烯基；或 A 和 B 合在一起代表与所连接的碳形成具有 4 至 10 个原子的取代或未取代碳环的原子，任何具有 1 至 10 个碳原子的烷基、取代烷基、烷氧基或取代烷氧基取代基，任何芳基或取代芳基为未取代或取代苯基、萘基或蒽基，取代芳基中的任何取代基为氨基、烷基氨基或二烷基氨基，或如 X、X'、Y 和 Y' 所定义的取代基。
• Polyesters comprising recurring photoconductive and photocrosslinkable units and elements thereof
  申请人：EASTMAN KODAK COMPANY (a New Jersey corporation)

  公开号：EP0199467B1

  公开（公告）日：1989-02-08
• US4018606A
  申请人：——

  公开号：US4018606A

  公开（公告）日：1977-04-19
• US4609606A
  申请人：——

  公开号：US4609606A

  公开（公告）日：1986-09-02