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What is the main use of 2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine?
2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine has a wide range of uses. In the field of medicinal chemistry, it is often used as a key intermediate and participates in the synthesis of many drugs. The unique chemical activity and structural properties of the geinpyridine ring with cyano groups, chlorine atoms and fluorophenyl groups can be combined with other molecular fragments through various chemical reactions to construct compounds with complex structures and specific pharmacological activities. For example, when developing new therapeutic drugs for specific diseases, this is used as a starting material and modified by multi-step reactions, which is expected to obtain targeted, efficient and low-toxicity drug molecules.
In the field of materials science, this compound also has applications. Due to its structure endowing the material with specific electrical, optical or mechanical properties, it can be used to prepare organic optoelectronic materials. For example, the preparation of organic Light Emitting Diode (OLED) materials, with its structural characteristics, can achieve efficient electron transmission and energy conversion under the action of electric field, thereby improving the luminous efficiency and stability of OLED devices.
In the field of pesticide chemistry, 2-chloro-3-cyano-6- (4-fluorophenyl) pyridine also plays an important role. It can be used as a key structural unit for the synthesis of new pesticides. Using its special mechanism of action against certain pests or pathogens, high-efficiency, low-residue and environmentally friendly pesticide products can be developed, which can help agricultural pest control and ensure crop yield and quality.
What are the synthesis methods of 2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine
The synthesis method of 2-chloro-3-cyano-6- (4-fluorophenyl) pyridine is described in detail by you today.
One method can also be started from compounds containing pyridine rings. First take the appropriate pyridine derivative, which has a modifiable group at a specific position, such as a halogen atom or other active substituent. At the appropriate check point of this pyridine derivative, introduce a cyano group. The method of introducing a cyanide group can often be used by cyanide reagents, such as potassium cyanide, sodium cyanide, etc., under suitable reaction conditions, to replace the original suitable group with a cyanide group. In this reaction, attention must be paid to the reaction temperature, reaction time and the choice of reaction solvent to ensure that the cyanyl group can be introduced into the target position accurately.
After the cyanyl group is successfully introduced, 4-fluorophenyl is introduced at another specific position of the pyridine ring, that is, the 6-position. This step can be achieved by arylation reaction. Select a suitable reagent containing 4-fluorophenyl to achieve the coupling of 4-fluorophenyl to the pyridine ring under the action of metal catalysts such as palladium catalysts. In the reaction, the amount of metal catalyst and the choice of ligand will affect the efficiency and selectivity of the reaction.
The second method can first construct the skeleton of the pyridine ring. Using several simple organic compounds as raw materials, the pyridine ring is gradually built through a multi-step reaction. In the process of constructing the pyridine ring, the reaction sequence is cleverly designed, so that at the time of cyclization reaction, cyano, chlorine atoms and groups that can further introduce 4-fluorophenyl are pre-arranged. After the cyclization reaction, 4-fluorophenyl is introduced under specific reaction conditions. In this process, the reaction conditions for the construction of the pyridine ring, such as the ratio of reactants, reaction temperature, pH, etc., need to be carefully adjusted to obtain the ideal intermediate, which lays a good foundation for the subsequent introduction of 4-fluorophenyl.
Another method can start with 4-fluorophenyl related compounds. First, 4-fluorophenyl is suitably modified to have an active group that can be linked to the pyridine ring. At the same time, the intermediate of pyridine derivatives containing chlorine atoms and cyanyl groups is prepared. Then, through a suitable linking reaction, the modified 4-fluorophenyl is connected to the chlorine-containing and cyanyl-containing pyridine intermediates to obtain the target product 2-chloro-3-cyano-6- (4-fluorophenyl) pyridine. The ligation reaction requires the selection of suitable reaction conditions and reagents according to the selected active group to ensure the smooth progress of the reaction.
What are the physical properties of 2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine
2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine, an organic compound. Its physical properties are particularly important and are related to many chemical and industrial applications.
The first word about its appearance is usually a white-like to light yellow crystalline powder. This color and morphology are very helpful for the preliminary identification and judgment of the compound. Its powdery state also suggests that it may have a high specific surface area, which may affect its reactivity and solubility.
As for the melting point, it is about 148-152 ° C. As a key physical property, the melting point is not only used for the identification of purity, but also closely related to the lattice structure and intermolecular forces of the compound. In this temperature range, the compound changes from solid state to liquid state, and the arrangement and motion state of its molecules change significantly.
In terms of solubility, the compound is slightly soluble in water. This property is related to the polarity of water and its own molecular structure. Although there are polar groups in its molecule, the non-polar parts such as aromatic rings account for a large proportion, making it insoluble in water with strong polarity. However, it is soluble in common organic solvents such as dichloromethane, N, N-dimethylformamide (DMF), etc. Good solubility in organic solvents facilitates the operation of organic synthesis reactions, and many reactions can proceed smoothly in these solvent systems.
In addition, the density of the compound also has its own characteristics. Although the exact value needs to be determined by specific experiments, it can be inferred that its density is relatively moderate based on its molecular composition and structure. The size of the density is of great significance in practical operations such as material measurement and phase separation. The physical properties of 2-chloro-3-cyano-6- (4-fluorophenyl) pyridine, such as its appearance, melting point, solubility, and density, play a decisive role in its applications in chemical research, drug synthesis, and materials science.
What are the chemical properties of 2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine
2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine, this is an organic compound with unique chemical properties.
In terms of physical properties, it may be a solid under normal conditions. Due to the specific arrangement and interaction of atoms in the molecule, it has a certain melting point and boiling point. However, the exact value varies depending on the specific preparation and test conditions of pure substances. And due to the existence of various groups in the molecular structure, or the specific crystal form, it affects its appearance and accumulation mode.
In terms of chemical properties, the chlorine atom endows the compound with nucleophilic substitution reaction activity. Chlorine is a good leaving group, and when it encounters a suitable nucleophilic reagent, it is prone to nucleophilic substitution. In case of nucleophilic reagents containing hydroxyl and amino groups, chlorine atoms can be replaced to form new derivatives, thereby expanding their application in the field of organic synthesis.
Cyanyl groups are active and can participate in a variety of reactions. Can hydrolyze to form carboxyl groups, or be converted into amino groups by reduction. Cyanyl groups can also undergo addition reactions with compounds containing active hydrogen, such as alkali catalyzed with alcohols to form imide ether intermediates, and then hydrolyzed to esters, enriching the derivation path of the compound.
The benzene ring and the pyridine ring endow their conjugated system to make the molecule have certain stability. The benzene ring and the pyridine ring can undergo electrophilic substitution reactions, such as halogenation, nitrification, sulfonation, etc. Due to the electron-withdrawing effect of pyridine ring nitrogen atom, the regioselectivity of the substitution reaction is different from that of benzene, which provides the possibility for the synthesis of various derivatives.
4-fluorophenyl fluorine atoms have strong electronegativity, which reduces the density of the o-para electron cloud, but because of its special p-π conjugation, it can still guide the substituent into the o-para position during the electrophilic substitution reaction. At the same time, fluorine atoms have a significant impact on the lipid solubility and metabolic stability of molecules, which is of great significance in the field of medicinal chemistry.
This compound has a wide range of uses in organic synthesis, drug research and development, materials science and other fields due to the above chemical properties. It can be used as a key intermediate to construct complex structural compounds through a series of reactions
What is the price range of 2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine in the market?
2-Chloro-3-cyano-6- (4-fluorophenyl) pyridine, which is a key organic synthesis intermediate in the field of fine chemicals, is widely used in medicine, pesticides and many other fields.
However, it is difficult to specify the price range in the market. The reason is that the price is often affected by many factors, such as raw material cost, synthesis process, market supply and demand situation, production scale and quality specifications.
Let's talk about the cost of raw materials first. If the market price of raw materials fluctuates frequently, the cost will also fluctuate, which will affect the final product price. Furthermore, if the synthesis process adopts advanced and efficient processes, although production efficiency and product purity may be improved, the upfront R & D investment and equipment purchase costs may also be expensive, resulting in product prices being affected.
Market supply and demand trends also have a great impact on prices. If the market has strong demand for this product and the supply is relatively short, the price will rise; conversely, if the market is saturated and the supply is sufficient, the price may decline. Production scale is also an important factor. In large-scale production, the unit production cost may be reduced due to the scale effect, thus making the price more competitive. In small-scale production, the cost is relatively high and the price will be higher.
In addition, the product quality specifications are different, and the price also varies. The price of high-purity, high-quality products is usually higher than that of ordinary quality products due to the difficulty of production.
According to past market conditions and price trends of similar products, the price of this product may range from a few hundred to several thousand yuan per kilogram. However, this is only a rough estimate. The real price needs to be combined with the actual situation of the current market and can only be determined by consulting relevant suppliers or industry insiders.