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2-n-propyl-4-methyl-6- (methylbenzimidazol-2-yl) What is the chemical structure of benzimidazole
This is an analysis of the chemical structure of 2-n-propyl-4-methyl-6- (methylbenzimidazole-2-yl) benzimidazole. Looking at its name, its structure can be analyzed step by step.
"2-n-propyl" means that at position 2 of the core structure of benzimidazole, there is a n-propyl group (-CH -2 CH -2) connected. This n-propyl group is formed by connecting three carbon atoms in a straight chain, and one end is connected to a specific position of the core structure of benzimidazole.
"4-methyl", expressed at position 4 of the benzimidazole structure, with methyl (- CH <). The methyl group contains only one carbon atom and three hydrogen atoms, and is succinctly and firmly connected to the benzimidazole structure.
"6 - (methylbenzimidazole-2-yl) ", which indicates that at position 6 of the benzimidazole core structure, a methylbenzimidazole-2-yl is connected. Methylbenzimidazole itself is also a complex structure, and its position 2 is connected to position 6 of the main structure. Among them, methylbenzimidazole is formed by fusing the benzene ring with the imidazole ring, and there is also a methyl group at a specific position on the structure.
Overall, this compound uses benzimidazole as the core parent, and is connected to n-propyl, methyl and methylbenzimidazole-2-group at positions 2, 4, and 6, respectively. Each substituent affects each other to shape a unique chemical structure and properties. Such a structure may affect its physical and chemical properties, and may have specific application potential in the fields of pharmaceutical chemistry, materials science, etc.
2-n-propyl-4-methyl-6- (methylbenzimidazol-2-yl) What are the main uses of benzimidazole
2-Propyl-4-methyl-6- (methylbenzimidazole-2-yl) benzimidazole, an organic compound, has important uses in many fields.
In the field of pharmaceutical research and development, it is often a key intermediate. Inbenzimidazole compounds often have various biological activities, such as antibacterial, antiviral, anti-tumor, etc. With this compound as the starting material, chemically modified and structurally optimized, new drugs with good efficacy and high specificity can be created. For example, by modifying its side chain or benzimidazole ring, the affinity of the drug with a specific target can be enhanced, thereby improving the therapeutic effect and reducing the side effects.
In the field of materials science, it also exhibits unique properties. Some benzimidazole derivatives have good thermal stability and optical properties, which can be applied to the modification of polymer materials. Introducing this compound into the polymer system may improve the heat resistance, mechanical properties and photoelectric properties of the material. For example, when preparing high-performance engineering plastics, adding an appropriate amount of compounds containing this structure can maintain good physical properties in high temperature environments and broaden its application range.
Furthermore, in the field of agriculture, due to its biological activity, it may be developed as a new type of pesticide. It may have inhibitory or killing effects on some crop diseases and pests, and compared with traditional pesticides, it may have lower toxicity and better environmental compatibility, which helps to promote the development of green agriculture.
In addition, in organic synthesis chemistry, this compound can participate in the construction of many complex organic molecules as an intermediate. With its specific structure and reactivity, chemists can synthesize organic compounds with novel structures and unique functions by ingeniously designing reaction routes, providing new opportunities and directions for the development of organic synthesis chemistry.
2-n-propyl-4-methyl-6- (methylbenzimidazol-2-yl) What are the synthesis methods of benzimidazole
There are currently methods for the synthesis of 2-n-propyl-4-methyl-6- (methylbenzimidazole-2-yl) benzimidazole, which are described in detail as follows.
First of all, the selection of raw materials is crucial. Suitable substituted benzimidazole derivatives are often used as starting materials, and these derivatives must have a check point of reactivity to facilitate subsequent reactions.
One method is to first carry out a nucleophilic substitution reaction with a specific halogenated hydrocarbon containing a suitable substituent under suitable reaction conditions. In halogenated hydrocarbons, the activity of halogen atoms and the structure of hydrocarbon groups have a great influence on the reaction. In this reaction, a suitable base is selected as the acid binding agent to promote the positive progress of the reaction. The strength and dosage of the base need to be carefully controlled. If it is too strong or too much, it is easy to cause side reactions; if it is too weak or too little, the reaction rate will be delayed. The reaction temperature and time are also important factors, and need to be carefully adjusted according to the raw materials and reaction process.
Furthermore, the structure of the target molecule can be constructed through the cyclization reaction. The interaction between the active groups in the molecule is used to promote the cyclization of the molecule in the presence of the catalyst. The type and dosage of catalysts are related to the efficiency and selectivity of the cyclization reaction. Certain metal catalysts or organic catalysts play a key role in this process. The properties of the reaction solvents also have an impact on the reaction. The polarity and solubility of different solvents can change the stability of the reaction intermediates, which in turn affects the reaction path and product yield.
During the synthesis process, it is indispensable to monitor the reaction progress. Thin layer chromatography (TLC) is often used to track the reaction, and the completion of the reaction is judged according to the change of spots. When the reaction is completed, it needs to be separated and purified to obtain high-purity products. Column chromatography or recrystallization method is commonly used. Column chromatography can separate the different adsorption capacities of different fillers to each component in the mixture; recrystallization can achieve the purpose of purification according to the solubility of the product and impurities in a specific solvent with the change of temperature.
This synthesis method requires fine control of each reaction condition and close connection of each step to effectively obtain 2-n-propyl-4-methyl-6- (methylbenzimidazole-2-yl) benzimidazole.
2-n-propyl-4-methyl-6- (methylbenzimidazol-2-yl) What are the physical properties of benzimidazole
2-Propyl-4-methyl-6-benzimidazole (methylbenzimidazole-2-yl) benzimidazole is an organic compound. According to its physical properties, it is mostly solid at room temperature and pressure. Its melting point is within a specific temperature range, which is critical for the identification and purification of the compound.
The solubility of this compound also has characteristics. It exhibits a certain solubility in common organic solvents such as ethanol and dichloromethane. This property is conducive to its dispersion and reaction in the system when it acts as a reactant or product in an organic synthesis reaction. In water, its solubility is poor. Due to the molecular structure of the compound, the benzimidazole ring and alkyl group are hydrophobic groups, which makes it difficult to form effective interactions with water molecules.
Its appearance may be white to light yellow powder. This color and morphology can be used as an important basis for the preliminary identification and quality judgment of the compound. Furthermore, the density of the compound is a specific value, and this physical parameter is crucial in the case of mass and volume conversion.
Its stability is stable under general environmental conditions. In case of extreme conditions such as high temperature, strong oxidizer or strong acid and alkali, the molecular structure may be damaged, causing chemical properties to change.
The physical properties of this compound have a profound impact on its application in many fields such as organic synthesis and drug development. Scientists need to rationally design reaction routes and optimize separation and purification methods based on these properties to achieve its maximum value.
2-n-propyl-4-methyl-6- (methylbenzimidazol-2-yl) How safe is benzimidazole
2-Propyl-4-methyl-6-benzimidazole (methylbenzimidazole-2-yl) benzimidazole is a chemical substance. Its safety is related to many aspects, and it is an important matter that needs to be investigated in detail.
Looking at its situation in the environment, if it accidentally flows into natural water bodies, its decomposition and transformation state will cause toxicity to plankton, fish and other organisms in aquatic ecosystems, affecting their growth and reproduction. In the soil, whether residual accumulation will affect the structure and function of soil microbial communities, and then affect plant growth, cannot be ignored.
Discussing the effect on the human body again. From the perspective of inhalation, if the substance is dispersed in the air in the form of dust or vapor in the production and processing site and inhaled by the human body, whether it will irritate the respiratory tract, cause cough, asthma, and whether long-term exposure has a carcinogenic risk, this needs to be considered. Whether skin contact will cause skin allergies, redness, swelling, itching and other symptoms. If accidentally ingested, whether chemical reactions will occur in the gastrointestinal tract, causing damage to the digestive system, such as abdominal pain, vomiting, etc.
However, the conclusion on the safety of this substance needs to be supported by a large number of rigorous and scientific experimental data. It is necessary to determine its half lethal dose and other indicators through toxicological experiments to clarify its acute toxicity; carry out subchronic and chronic toxicity experiments to understand the effects of long-term low-dose exposure; carry out mutagenic, teratogenic, carcinogenic and other special toxicity experiments to comprehensively evaluate its potential harm. It is also necessary to consider the sensitivity differences of different individuals due to factors such as age, sex, genetics, etc. Only in this way can we have a more accurate and comprehensive understanding of the safety of 2-n-propyl-4-methyl-6- (methylbenzimidazole-2-yl) benzimidazole.