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6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] What are the main application fields of imidazole?
6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole is often a key intermediate for the creation of new drugs in the field of pharmaceutical research and development. Due to the diverse biological activities of benzimidazole compounds, such as anti-tumor, antiviral, antibacterial, etc., this specific structural compound may play an important role in the development of related drugs.
In the field of materials science, benzimidazole derivatives often exhibit unique optoelectronic properties, or can be used in the preparation of organic Light Emitting Diode (OLED), solar cells and other optoelectronic devices. 6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole or its special substituent endows the material with specific optical and electrical properties, adding new possibilities for material design and optimization.
Furthermore, in the field of pesticides, some benzimidazole compounds have insecticidal and bactericidal activities. This compound may be modified and modified to develop into a new type of high-efficiency pesticide for the control of crop diseases and pests and the protection of agricultural production.
In summary, 6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole has potential application value in many important fields such as medicine, materials, and pesticides, which has attracted the attention of scientific research and industrial production.
What are the synthesis methods of 6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole
There are many ways to synthesize 6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole. The details are as follows:
First, suitable substituted benzaldehyde and 1-isopropyl-2-methyl-1H-benzo [d] imidazole-6-amine can be used as starting materials. First, the substituted benzaldehyde and amine compounds are condensed under suitable reaction conditions, such as mild heating and the presence of a specific catalyst. In this process, the aldehyde group interacts with the amino group to dehydrate to form an imine intermediate. Subsequently, under the action of halogenating agents, such as brominating agents and fluorinating agents, bromine atoms and fluorine atoms are introduced respectively to obtain the target product. The key to this route is to control the conditions of the condensation reaction. It is necessary to choose a suitable solvent, such as ethanol or dichloromethane, to ensure the smooth progress of the reaction. The halogenation step also needs to be precisely regulated to avoid side reactions such as excessive halogenation.
Second, 6-halo-1-isopropyl-2-methyl-1H-benzo [d] imidazole can also be used as the initial material. Through a halogen exchange reaction, with a suitable fluorine source, such as potassium fluoride, etc., with the assistance of a phase transfer catalyst, the original halogen atom is partially replaced with a fluorine atom. Subsequently, bromine atoms are introduced at the appropriate reaction check point using a brominating reagent. This method requires precise consideration of the temperature, time and amount of fluorine source of the halogen exchange reaction to achieve the best reaction effect, and the subsequent bromination reaction should also avoid affecting the introduced fluorine atoms.
Third, the benzimidazole ring structure can be constructed by a multi-step reaction starting from the basic benzene ring compound. Substituents such as isopropyl, methyl, etc. are first introduced into the benzimidazole ring, and then a benzimidazole skeleton is formed through a cyclization reaction. After that, the bromination and fluorination reactions are carried out in an orderly manner to obtain the target 6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole. There are many steps in this path, but the selectivity and yield of each step are crucial to the synthesis of the final product, and the reaction conditions of each step need to be carefully regulated, such as the ratio of reaction reagents, reaction temperature and reaction time.
What are the physical and chemical properties of 6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole
6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole, which is an organic compound. Looking at its physical and chemical properties, it has the following characteristics:
First of all, the physical properties are mostly solid at room temperature. Its melting point and boiling point are affected by intermolecular forces. The existence of halogen atoms such as bromine and fluorine, as well as isopropyl and methyl in the molecule makes the intermolecular forces complex. Due to the high electronegativity of halogen atoms, intermolecular dipole-dipole forces will be enhanced, while alkyl groups affect the spatial structure and dispersion forces of molecules. Therefore, it is speculated that its melting point may be in a relatively high range, and the specific value needs to be accurately determined experimentally. Its boiling point will also increase due to the enhancement of intermolecular forces. Due to the molecular structure, the intermolecular bonds are close, and more energy is required to vaporize it.
In terms of solubility, according to the principle of similarity dissolution, the compound is an organic molecule and has certain hydrophobicity. The solubility in water is very small, because water is a polar solvent, and although this compound has polar groups, the overall non-polar part accounts for a large proportion. However, in common organic solvents such as dichloromethane, chloroform, toluene, etc., the solubility should be better, because these organic solvents match the intermolecular forces of the compound, which can effectively disperse and dissolve the substance.
Re-discussion of chemical properties, its benzimidazole ring has certain aromaticity and stability. However, bromine and fluorine atoms on the ring are active and can participate in nucleophilic substitution reactions. In case of nucleophilic reagents, bromine atoms can be replaced to form new derivatives. Although fluorine atoms have high electronegativity and slightly lower reactivity than bromine atoms, they can also participate in the reaction under specific conditions, changing the distribution of molecular electron clouds, affecting the reactivity and selectivity.
The existence of 1-position isopropyl and 2-position methyl has an impact on the electron cloud of the benzimidazole ring. Alkyl groups have electron-induced effects, which increase the density of the electron cloud of the benzimidazole ring, enhance its nucleophilicity, and make it easier to react with electrophilic reagents. Under appropriate conditions, electrophilic substitution reactions on the benzene ring can occur, such as halogenation, nitrification, sulfonation, etc., and the steric resistance of isopropyl and methyl groups will also affect the reaction check point and product selectivity.
6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] what is the price of imidazole in the market
6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole is difficult to break at the market price. Its price often varies due to various factors, and various situations cannot be ignored.
First, the price of raw materials is very close. If the various raw materials required for its preparation are abundant, easy and inexpensive to purchase, the price of the finished product may also become more affordable. On the contrary, if the raw materials are rare and difficult to harvest, the price will be high, and the price of the finished product will rise.
Second, the technique of preparation is also the main reason. The process is exquisite and efficient, the yield is high and the cost is reduced, and the price may be close to the people. If the process is complicated, time-consuming and laborious, and the cost is greatly increased, the price will also be high.
Third, the supply and demand of the city determines the price. If there are many seekers and few suppliers, the price will rise; if supply exceeds demand, the price will fall. And the trend of market competition cannot be ignored. The same industry competes for sales, in order to compete for customers, or there may be price reductions.
Fourth, the difference in regions varies according to the price. In places with four quarters, the price is also different due to differences in taxes, freight, and market conditions. Long-distance transshipment is expensive and the price may be higher than that of the place of origin.
From this perspective, if you want to know the exact price of 6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole, you must carefully consider the above things, visit merchants, and consult the industry to obtain a more accurate number, which is difficult to explain.
What are the precautions in the preparation of 6-Bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole
When preparing 6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo [d] imidazole, many key matters need to be paid attention to.
The selection of starting materials is of paramount importance. Its purity must be excellent. If impurities exist, they will seriously interfere with the reaction process and cause impure products. If the selected halogenated aromatics contain other halogenated impurities, by-products will be formed in the subsequent reaction, which will increase the difficulty of separation.
The control of the reaction conditions must not be lost. In terms of temperature, this reaction is sensitive to temperature. If the temperature is too high, the reaction rate will be too fast, which will lead to side reactions, such as excessive halogenation of benzimidazole rings; if the temperature is too low, the reaction will be delayed or even stagnant, and the yield will be greatly reduced. Take a similar reaction as an example. For every 10 ° C increase in temperature, the amount of by-products generated increases by about 15%. The reaction time also needs to be accurate. If the reaction time is too short, the reaction will not be completed, and the raw material will remain too much. If the time is too long, the product may decompose or further react. The use of
catalysts is crucial. A suitable catalyst can accelerate the reaction and increase the yield. However, the amount of catalyst should be appropriate. Too much will increase the cost and may catalyze unnecessary side reactions; For example, in an imidazole synthesis reaction, the catalyst dosage is increased from 0.5mol% to 1mol%, the yield is increased by 10%, but it continues to increase to 1.5mol%, and the by-products increase, but the yield decreases.
The choice of reaction solvent is also crucial. It should be selected according to the solubility and reaction mechanism of the reactants and products. Solvent polarity discomfort will affect the dispersion and reactivity of the reactants. Aprotonic polar solvents may be more favorable for nucleophilic substitution steps. If the wrong choice is a protonic solvent, the nucleophilic reagent may be inactivated.
Separation and purification steps cannot be ignored. After the reaction, the product is mixed with raw materials, by-products and catalysts. The separation method should be selected according to the characteristics of the product, such as recrystallization, and a suitable solvent should be selected to dissolve the product in a hot solvent, and precipitate after cooling, while impurities remain in the mother liquor. If the solvent is not selected properly, the product and impurities may precipitate together or remain in the solution, and separation cannot be achieved. When column chromatography separation, the selection of stationary phase and eluent should be accurate, otherwise it is difficult to effectively separate the components.