3-[4-(3-oxo-3-pyridin-2-yl-propenyl)-phenyl]-1-pyridin-2-yl-propenone | 210306-18-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: 3-[4-(3-oxo-3-pyridin-2-yl-propenyl)-phenyl]-1-pyridin-2-yl-propenone
• 英文别名: 3,3'-(1,4-Phenylene)bis[1-(2-pyridinyl)-2-propen-1-one；(E)-3-[4-[(E)-3-oxo-3-pyridin-2-ylprop-1-enyl]phenyl]-1-pyridin-2-ylprop-2-en-1-one
• CAS: 210306-18-6
• 化学式: C₂₂H₁₆N₂O₂
• 分子量: 340.381
• InChiKey: KORKCLCUVKAFAI-PHEQNACWSA-N

物化性质

• 熔点：
  148-150 °C
• 沸点：
  578.0±50.0 °C(Predicted)
• 密度：
  1.37 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  59.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-[4-(3-oxo-3-pyridin-2-yl-propenyl)-phenyl]-1-pyridin-2-yl-propenone 在 yttrium(III) hexafluoroacetylacetonate 盐酸羟胺 作用下， 以 二氯甲烷 、 乙腈 为溶剂， 反应 6.0h， 生成 1,4-bis-([2,2']bipyridin-4-yl)-benzene
  参考文献：
  名称：

  Synthesis of mono-substituted 2,2′-bipyridinesElectronic supplementary information (ESI) available: experimental details and full characterization of new compounds. See http://www.rsc.org/suppdata/cc/b2/b203595b/

  摘要：

  快速合成4-芳基-2,2'-联吡啶的方法被描述，该方法不仅有效制备了一些先前报道过的化合物并且还得到了一些新型功能化联吡啶，产率均较高。

  DOI：

  10.1039/b203595b
• 作为产物：
  描述：

  2-乙酰基吡啶 、 对苯二甲醛 在 sodium hydroxide 作用下， 以 甲醇 为溶剂， 反应 3.0h， 以65%的产率得到3-[4-(3-oxo-3-pyridin-2-yl-propenyl)-phenyl]-1-pyridin-2-yl-propenone
  参考文献：
  名称：

  Synthesis of mono-substituted 2,2′-bipyridinesElectronic supplementary information (ESI) available: experimental details and full characterization of new compounds. See http://www.rsc.org/suppdata/cc/b2/b203595b/

  摘要：

  快速合成4-芳基-2,2'-联吡啶的方法被描述，该方法不仅有效制备了一些先前报道过的化合物并且还得到了一些新型功能化联吡啶，产率均较高。

  DOI：

  10.1039/b203595b

文献信息

• Bis-terpyridine monomer
  申请人：Higuchi Masayoshi

  公开号：US20110213154A1

  公开（公告）日：2011-09-01

  A bis-terpyridine monomer includes a first terpyridyl substituent (A), a second terpyridyl substituent (B), and a spacer that contains at least one benzene ring and links the first terpyridyl substituent (A) and the second terpyridyl substituent (B). The bis-terpyridine monomer is represented by the following formula (10): where X 1 is a halogen; and R 1 , R 2 , R 3 and R 4 are each independently a halogen atom, an aryl group or an alkyl group.

  一种双三吡啶单体包括第一三吡啶取代基（A）、第二三吡啶取代基（B）和一个至少含有一个苯环并连接第一三吡啶取代基（A）和第二三吡啶取代基（B）的间隔物。该双三吡啶单体由以下公式（10）表示： 其中X1为卤素；而R1、R2、R3和R4分别独立地为卤素原子、芳基或烷基。
• New solid-state Eu(<scp>iii</scp>)-containing metallo-supramolecular polymers: morphology control and optical wave-guiding properties
  作者：Andre Duerrbeck、Sergey Gorelik、Jonathan Hobley、Anna Marie Yong、Gomathy Sandhya Subramanian、Andy Hor、Nicholas Long

  DOI：10.1039/c5tc01703c

  日期：——

  Herein, we report the solution phase self-assembly between Eu(III) and a rigid ditopic tridentate terpyridine ligand which results in the formation of supramolecular metallo-networks in the solid state. Depending on the ligand to metal ratio used for the initial self-assembly process, the morphology of these materials can be altered from one-dimensional micron-sized fibres to a three-dimensional coordination

  在本文中，我们报道了Eu（III）与刚性二位三齿三联吡啶配体之间的溶液相自组装，这导致了固态的超分子金属网络的形成。根据用于初始自组装过程的配体与金属的比例，这些材料的形态可以从一维微米级纤维变为三维配位网络。基于三联吡啶的对位配体可作为Eu（III）发射的有效敏化剂，因此金属聚合物的发射寿命和配体三态态能量在很大程度上取决于配体与金属的比率。所获得的微米级纤维可以作为有效的Eu（III）发射光波导。
• Use of Molecular Recognition To Drive Chemical Evolution: Mechanisms of an Automated Genetic Algorithm Implementation
  作者：Alexey V. Eliseev、Marina I. Nelen

  DOI：10.1002/(sici)1521-3765(19980515)4:5<825::aid-chem825>3.0.co;2-7

  日期：——

  A detailed description is provided for a new general approach that allows production of amplified amounts of effective noncovalent binders from pools of compounds that can exist in a dynamic equilibrium. This approach involves a) selective binding of the effective pool components by the immobilized target compound; b) equilibration of the pool remaining after selection, and thereby regeneration of the effective components; c) repetition of the selection-equilibration cycles. It represents a new automated, implementation of a genetic algorithm/mechanism in a chemical system. Application of the approach to the generation of arginine binders involved the synthesis and screening of eight compounds, each of which was capable of forming a pool of three isomers (trans,trans, trans,cis, and cis,cis) that could be interconverted by photoisomerization. These compounds were screened for their affinity for, or selectivity of binding to, guanidinium derivatives. The most promising compound was then used in our method to generate an amplified amount of the cis,cis isomer, the strongest binder from the equilibrating pool. The receptors were selected using an arginine derivative immobilized on the modified silica gel support, which had been found to possess binding affinity and selectivity similar to those of guanidinium salts in solution. Mathematical models of the approach were developed that allowed us to evaluate the importance of various experimental parameters and to assess the applicability of the method to larger combinatorial pools.
• Supramolecular architectures constructed through self-assembly of a chalcone and substituted diazo-β-diketones
  作者：R. Prajapati、L. Mishra、S.J. Grabowski、G. Govil、S.K. Dubey

  DOI：10.1016/j.molstruc.2007.08.011

  日期：2008.5

  Organic compounds namely pyridyl chalcone viz. 3-[4-(3-oxo-3-pyridin-2-yl-propenyl)-phenyl]-1-pyridin-2-yl-propenone (L-1), p-cliolorophenyldiazopentane-2,4-dione (L-2) and p-methyl phenyidiazopentane-2,4-dione (L-3) have been characterized by their single-crystal X-ray crystallographic studies. Several structural motifs resulting upon their self-association through probable non-covalent interactions have been discussed. The studies of related motifs found in Cambridge Structural Database are performed and the results are related to the structural data obtained for crystal structures reported here in. (C) 2007 Elsevier B.V. All rights reserved.
• Convenient Synthesis of<i>bis</i>-Bipyridines and<i>bis</i>-Terpyridines Bridged by Phenyl and Biphenyl Tethers
  作者：Aaron I. Baba、Wei Wang、Wong Yong Kim、Laura Strong、Russell H. Schmehl

  DOI：10.1080/00397919408020779

  日期：1994.4

  A simple three step Preparation of phenyl bridged bis-2,2'-bipyridine and bis- 2,2':6',2''-terpyridine from readily available reagents is described. The compounds have the potential to serve as rigid bridging ligands for the preparation of redox and photoactive supramolecular complexes of transition metals.