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4-iodo-1-methyl-imidazole chemical structure of hydrochloride
4-Iodo-1-methyl-imidazole hydrochloride is an organic compound with a unique chemical structure. The compound is based on an imidazole ring, which is connected to an iodine atom at position 4 and a methyl group at position 1, and combines with hydrochloric acid to form a hydrochloride salt.
The imidazole ring is a five-membered heterocycle containing two nitrogen atoms, which has aromatic properties and has a profound impact on the stability and reactivity of the compound. The iodine atom at position 4, because the iodine atom has a large atomic radius and relatively high electronegativity, can change the electron cloud distribution of the molecule, affect the polarity and chemical reactivity of the compound, such as in the nucleophilic substitution reaction, the iodine atom can be used as a leaving group to promote the reaction. The methyl group at position 1, which is an alkyl group, has the electron effect, which can change the electron density of the imidazole ring and affect its interaction with other molecules.
And the hydrochloride salt formed by the compound and hydrochloric acid means that the molecule binds hydrogen ions and exists in the form of salts. This form can improve the solubility of the compound in water, because the ionic compound has better solubility in polar solvents. The formation of hydrochloride also affects the physical and chemical properties of compounds, such as melting point, boiling point, etc. In the field of medicinal chemistry and organic synthesis, this property is often used to improve the specific properties of compounds to meet different application requirements.
What are the main uses of 4-iodo-1-methyl-imidazole hydrochloride?
4-Iodine-1-methyl-imidazole hydrochloride, which has a wide range of uses. In the field of medicinal chemistry, it is often a key intermediate. Due to its unique structure, it can undergo a variety of chemical reactions to derive various bioactive compounds, such as some new drug molecules with specific pharmacological effects. Doctors make good medicines to treat diseases, which is one of its great uses.
In materials science, it also has outstanding performance. Or can participate in the synthesis of materials, giving materials different properties. For example, in the preparation of some functional polymer materials, 4-iodine-1-methyl-imidazole hydrochloride can be used as an initiator or modifier to optimize the conductivity and stability of the material, and open up new ways for the use of materials.
Furthermore, in the field of organic synthetic chemistry, it is an important reagent. Organic chemists use its reaction with various substrates to construct complex organic molecular structures, expand the variety of organic compounds, help the development of organic synthetic chemistry, and contribute to the exploration of new substances and new properties. It is an indispensable substance in many aspects such as chemical industry and scientific research.
What are the physical properties of 4-iodo-1-methyl-imidazole hydrochloride?
4-Iodine-1-methyl-imidazole hydrochloride is also an organic compound. Its physical properties are worth exploring.
First of all, its appearance, at room temperature, is often solid, or crystalline, or has a certain luster in appearance, and its color is white or nearly white. This is the characterization of common organic salts.
When it comes to solubility, in polar solvents, such as water, because the molecular structure contains ionic parts, that is, ions formed by hydrochloride salts, it has good solubility. This property makes the compound easy to disperse and participate in the reaction in the chemical reaction of the aqueous solution system. In alcohol solvents, such as methanol and ethanol, there is also a certain solubility, but the solubility may vary depending on the carbon chain length of the alcohol and the intermolecular force.
Its melting point is also an important physical property. Determination of melting point can help to identify the purity of the compound. Pure 4-iodine-1-methyl-imidazole hydrochloride When there is a specific melting point range, if it contains impurities, the melting point may be offset or the melting range may be widened.
Furthermore, its density depends on its measurement and operation in practical application. Although the exact density value needs to be accurately determined experimentally, according to the laws of its molecular composition and similar compounds, it can be inferred that its density has a certain range, and because the iodine atoms in the molecule are relatively large in atomic weight, or the overall density is higher than that of ordinary small molecule organic compounds.
As for its volatility, due to the existence of ionic bonds between molecules and strong intermolecular forces, the volatility is weak, and it is not easy to volatilize to the gas phase at room temperature and pressure. This characteristic guarantees its stability during storage and operation.
What are the synthetic methods of 4-iodo-1-methyl-imidazole hydrochloride?
To prepare 4-iodine-1-methyl-imidazole hydrochloride, there are many methods, and the following are common methods.
One is to use 1-methyl-imidazole as the starting material. First, 1-methyl-imidazole is reacted with an iodine source, and the iodine element ($I_ {2} $) can be selected. In the presence of an appropriate oxidant, such as hydrogen peroxide ($H_ {2} O_ {2} $) or ammonium persulfate ($ (NH_ {4}) _ {2} S_ {2} O_ {8} $), in a suitable solvent, such as acetonitrile, dichloromethane, etc., electrophilic substitution reaction occurs. Iodine atoms will selectively replace specific positions on the imidazole ring to form 4-iodine-1-methyl-imidazole. After that, the resulting product can be reacted with hydrogen chloride gas or hydrochloric acid solution to obtain 4-iodine-1-methyl-imidazole hydrochloride. During this process, attention should be paid to the reaction temperature, the proportion of reactants and the reaction time. If the temperature is too high, it may cause side reactions and reduce the purity of the product; improper proportions or incomplete reactions will affect the yield.
The second method can start from imidazole. The methylation of imidazole is carried out first. The commonly used methylation reagents are iodomethane ($CH_ {3} I $), dimethyl sulfate ($ (CH_ {3}) _ {2} SO_ {4} $), etc. Under the action of alkali, such as potassium carbonate ($K_ {2} CO_ {3} $), sodium hydroxide ($NaOH $), react in suitable solvents such as acetone, N, N-dimethylformamide (DMF) to generate 1-methyl-imidazole. Then, according to the above method of using 1-methyl-imidazole as raw material, react with iodine source and hydrogen chloride to obtain the target product. This route has a little more steps, but the raw material imidazole is relatively easy to obtain. < Br >
During the preparation process, the product needs to be separated and purified at each step. Commonly used separation methods include extraction, distillation, column chromatography, etc. The purified product can be characterized by nuclear magnetic resonance (NMR), mass spectrometry (MS), infrared spectroscopy (IR) and other means to confirm its structure and purity.
4-iodo-1-methyl-imidazole hydrochloride in storage and transportation
4-Iodine-1-methyl-imidazole hydrochloride is also a chemical substance. When storing and transporting, many matters need to be paid careful attention.
First words storage, because of its nature, should be placed in a cool, dry and well-ventilated place. Avoid open fires and hot topics, which may cause dangerous reactions in such environments. If it is heated, or there is a risk of decomposition, it will release harmful gases, endangering the surrounding environment and personal safety. Storage should be kept away from oxidants. If the two come into contact, it is easy to cause violent chemical reactions and risk fire or explosion.
And it should be sealed to prevent it from coming into contact with moisture, oxygen and other substances in the air. Contact with water, or cause hydrolysis reaction, affecting its quality and stability; interact with oxygen, or be oxidized, changing its chemical properties.
As for transportation, it is necessary to follow relevant regulations and standards. Packaging must be solid and well sealed to resist vibration, collision and friction during transportation. Ensure that packaging materials can withstand the chemical properties of the substance and do not react with it. The means of transportation should also be clean, dry and free of other substances that can react with it. During transportation, closely monitor temperature and humidity to prevent environmental factors from adversely affecting it. Escort personnel should have professional knowledge and know the characteristics of the substance and emergency treatment methods. In case of emergencies, they can respond quickly and correctly to ensure the safety of transportation.