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What is the chemical structure of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine?
4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine, this is an organic compound. To understand its chemical structure, let me explain in detail.
This compound is based on tripyridine. Pyridine is a nitrogen-containing hexaherocyclic compound with aromatic properties. Tripyridine, that is, three pyridine rings are connected in a specific way. Among them, the 2,2': 6 ', 2' -connection mode shows that the pyridine rings are connected to each other through the carbon atoms at the 2nd and 6th positions, forming a unique conjugate system, which endows the compound with unique electronic properties and coordination ability.
Furthermore, tert-butyl is introduced at the position of 4,4 ', 4'. Tert-butyl is a common substituent in organic chemistry with a structure of -C (CH <) <. Because of its large steric resistance, it has a great impact on the spatial structure and electron cloud distribution of compounds after introduction. From a spatial perspective, tert-butyl increases the molecular volume and changes the molecular shape and conformation; from the perspective of electronic effects, it is a power supply group, which can affect the electron cloud density of the pyridine ring, which in turn affects the reactivity and coordination properties of the compound.
Overall, 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine chemical structure, due to the special substitution of tripyridine conjugate system and tert-butyl, has unique electronic and spatial characteristics, and has broad application prospects in coordination chemistry, materials science and other fields, such as the preparation of new metal complexes luminescent materials, catalysts, etc.
What are the main uses of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine?
4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine, which has a wide range of uses. In the field of chemical synthesis, it is often used as a ligand. Due to its special structure and electronic properties, it can form stable complexes with many metal ions. In catalytic reactions, these complexes exhibit excellent catalytic performance and can effectively catalyze many organic reactions, such as the formation of carbon-carbon bonds, which can help organic synthesis to be achieved more efficiently.
In the field of materials science, it also has important uses. It can be used to prepare luminescent materials. With its unique optical properties after coordination with metal ions, it can be used in optoelectronic devices such as organic Light Emitting Diodes (OLEDs) to improve the luminous efficiency and stability of the devices, and contribute to the development of optoelectronic devices.
In the field of analytical chemistry, it is also indispensable. It can be used to specifically combine with metal ions to achieve sensitive detection and analysis of specific metal ions through spectroscopy and other means, providing an effective way for quantitative and qualitative analysis of metal ions.
In summary, 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine plays a key role in many fields such as chemical synthesis, materials science and analytical chemistry, and is of great significance in promoting the progress of related fields.
What are the synthesis methods of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine?
The synthesis method of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine can be obtained from the following ways.
First, the halogenated pyridine is used as the starting material and prepared by metal catalytic coupling reaction. If an appropriate halogenated pyridine is first taken, it interacts with tert-butyl lithium, and tert-butyl is introduced to obtain a halogenated pyridine intermediate containing tert-butyl. Next, a metal catalyst such as palladium and a ligand are added to this intermediate, and the coupling reaction is carried out with another halogenated pyridine at a suitable temperature and in the presence of a base, and the tripyridine structure is gradually constructed. In this way, metal catalysis can precisely control the reaction check point, improve the purity and yield of the product, but the reaction conditions are strict and the cost of metal catalysts is also high.
Second, based on pyridine derivatives, it is achieved through condensation reaction. First, the pyridine derivative containing a specific substituent is heated in an appropriate solvent under the action of an acidic or basic catalyst to promote intermolecular condensation to form a preliminary bipyridine structure. Subsequent modifications to the structure, such as the use of nucleophilic substitution reaction, the introduction of tert-butyl to complete the synthesis of the target product. This method is relatively simple to operate, and the raw materials are easy to obtain. However, the selectivity of the reaction needs to be finely regulated, otherwise it is prone to side reactions and the yield is reduced.
Third, with the help of heterocyclic synthesis strategy. With suitable nitrogen-containing heterocyclic precursors, through multi-step cyclization reaction, a pyridine ring is constructed and tert-butyl is introduced. If a compound containing nitrogen and suitable functional groups is selected, under specific reagents and conditions, a pyridine ring is first formed, and then the pyridine ring is modified, tert-butyl groups are introduced one after another and connected to tripyridine. This approach can start from basic raw materials and construct complex structures according to predetermined designs, but there are many steps and lengthy reaction routes, which require extremely high reaction conditions and intermediate product purification.
What are the physicochemical properties of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine?
4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine, which is an organic compound. Its physical and chemical properties are quite characteristic.
Looking at its physical properties, it is mostly solid under normal conditions and has a certain melting point. Because the molecule contains groups such as tert-butyl, it has a certain solubility in some organic solvents, such as common chloroform and dichloromethane. However, its solubility in water is poor, and the hydrophobicity of its molecules is strong.
When it comes to chemical properties, the pyridine ring of the compound is rich in nitrogen atoms and has a certain alkalinity, which can react with acids to form corresponding salts. At the same time, the π-electron system in its structure makes it have a certain electron conjugation effect, which shows unique properties in the fields of photophysics and electrochemistry. For example, it can absorb light of a specific wavelength and then undergo electron transition, which has great application potential in fluorescent materials. Moreover, with its conjugate structure and coordination ability, it can coordinate with a variety of metal ions to generate structurally stable complexes, which play an important role in catalysis, molecular recognition and other fields. Due to its steric resistance effect of tert-butyl, when participating in the reaction, it will affect the selectivity and rate of the reaction, or it can hinder some reaction check points and promote the reaction to proceed in a specific direction.
What are the advantages of 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine in related fields?
4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine has unique advantages in many fields.
In the field of materials science, its structure endows materials with excellent stability and unique electronic properties. Due to the steric resistance effect of tri-tert-butyl, the molecular structure of this substance is stable, which can effectively resist external environmental interference, and can still maintain stable performance under extreme conditions. At the same time, the structure of tripyridine can coordinate with metal ions to construct metal-organic complex materials with specific properties, which are widely used in luminescent materials, sensor materials, etc. For example, in luminescent materials, the color and efficiency of luminescence can be precisely adjusted, which can help the development of display technology.
In the field of catalysis, it is combined with metal catalysts as a ligand, which can significantly improve catalytic activity and selectivity. The electronic effect and spatial effect of tri-tert-butyl can adjust the electron cloud density and spatial environment of the metal center, promote the catalyst to be highly selective to specific reaction substrates, speed up the reaction process, reduce energy consumption, and improve the reaction efficiency and yield. For example, in organic synthesis reactions, it can efficiently catalyze the formation of carbon-carbon bonds and carbon-heteroatomic bonds.
In the field of chemical sensing, with the high selectivity of specific metal ions, highly sensitive chemical sensors can be designed. When there is a target metal ion in the environment, 4,4 ', 4' -tri-tert-butyl-2,2 ': 6', 2 '-tripyridine will specifically bind to it, causing changes in the physical and chemical properties of the system, such as color, fluorescence intensity, etc., in order to achieve rapid detection and quantitative analysis of metal ions, which is of great significance in environmental monitoring, biomedical testing, etc.