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What is the chemical structure of ETHYL 4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE?
ETHYL + 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE, this is the name of an organic compound. According to the chemical nomenclature, its chemical structure can be inferred as follows.
The main structure of this compound is a thiazole ring, which is a five-membered heterocycle containing sulfur and nitrogen. At the 2-position of the thiazole ring, there is a carboxylethyl ester group (-COOCH ² CH 🥰), which is obtained by esterification of carboxyl groups with ethanol. At the 4-position of the thiazole ring, there is an isopropyl group (-CH (CH 🥰) ³), which is formed by removing a hydrogen atom from the propane molecule. Therefore, the chemical structure of ETHYL + 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE is composed of thiazole ring, 2 - carboxylethyl ester group and 4 - isopropyl group. Based on the corresponding relationship between the positions and names of each group in the chemical nomenclature, the chemical structure of the compound can be accurately constructed according to this rule.
What are the main uses of ETHYL 4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE?
ETHYL+4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE is ethyl 4-isopropylthiazole-2-carboxylate, which has a wide range of uses and is often a key intermediate in the synthesis of medicine. Taking the creation of specific anti-infective drugs as an example, with its unique chemical structure, it can effectively participate in the construction of drug activity skeleton, help the drug to act accurately on pathogens, and achieve antibacterial and anti-inflammatory effects.
In the field of pesticides, it is also indispensable. For example, the synthesis of new insecticides, with its structural characteristics, endows pesticides with better biological activity and environmental adaptability, can effectively kill pests, reduce environmental harm, and protect crop growth.
In the field of materials science, ethyl 4-isopropylthiazole-2-carboxylate can be used to prepare functional materials. After a specific chemical reaction, it can be introduced into the polymer material structure, endowing the material with special optical and electrical properties, or enhancing the stability and durability of the material, expanding the application scenarios of the material.
In addition, in the preparation of fine chemical products, it can be used as an important raw material to participate in the synthesis of fragrances and additives. Synthesize fragrances with unique odors to add a different fragrance to perfumes, cosmetics, etc.; in the synthesis of additives, improve the properties of products such as anti-oxidation and anti-corrosion, and optimize product quality.
What are the synthetic methods of ETHYL 4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE?
ETHYL 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE, that is, 4 - isopropylthiazole - 2 - ethyl carboxylate, is synthesized as follows:
Take the appropriate starting material first, if the sulfur-containing compound and the suitable halogenated hydrocarbon are used as the starting material. For example, using ethyl 2-bromopropionate and isopropyl thiourea as raw materials, in a suitable reaction vessel, add an appropriate amount of solvent, such as ethanol or dimethylformamide (DMF). This solvent needs to be able to dissolve the reactants and not interfere with the reaction.
Subsequently, the reaction system is heated to a specific temperature, about 60-80 ° C. At this temperature, the nucleophilic substitution reaction between ethyl 2-bromopropionate and isopropyl thiourea occurs. The sulfur atom in isopropyl thiourea is nucleophilic and can attack the carbon atom connected to the bromine atom in ethyl 2-bromopropionate. Bromine ions leave to form an intermediate product.
During the reaction process, it is necessary to closely observe the changes of the reaction system, such as color, precipitation, etc. After the reaction has been carried out for a period of time, the reaction process is monitored by thin layer chromatography (TLC) or other suitable analytical methods until the raw material point disappears, indicating that the reaction is basically completed. After
, the reaction mixture is post-processed. The reaction liquid is first cooled to room temperature, and then an appropriate amount of water is added to dilute the reaction system. At this time, the product 4-isopropylthiazole-2-carboxylate ethyl ester will precipitate or stratify due to its low solubility in water. The organic phase is separated by a separation funnel, and the aqueous phase is extracted several times with an organic solvent such as ether or ethyl acetate to combine the organic phases.
The resulting organic phase is dried with anhydrous sodium sulfate or magnesium sulfate to remove any remaining moisture. After drying, the desiccant is filtered to remove, and the filtrate is distilled under reduced pressure to steam off the organic solvent to obtain a crude product. < Br >
To obtain pure 4-isopropylthiazole-2-carboxylic acid ethyl ester, the crude product was separated or recrystallized by column chromatography. If column chromatography is used, a suitable silica gel is selected as the stationary phase, and a mixed solvent of petroleum ether and ethyl acetate is used as the mobile phase. Separation is achieved according to the different adsorption and desorption capabilities of the product and impurities on the silica gel. If it is recrystallization, choose a suitable solvent, such as ethanol-water mixed solvent, heat to dissolve the crude product, filter while hot to remove insoluble impurities, and after cooling, the product crystallizes and precipitates, filters and dries to obtain a pure 4-isopropylthiazole-2-carboxylic acid ethyl ester.
What are the physical properties of ETHYL 4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE?
ETHYL 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE is an organic compound, the Chinese name is 4 - isopropylthiazole - 2 - ethyl carboxylate. The physical properties of this thing, let me tell you one by one.
Looking at its appearance, under room temperature and pressure, it is mostly a colorless to light yellow transparent liquid, which is as clear as a spring. Under the sunlight, there may be shimmering light, like a pearl hidden in the world. Its smell is quite unique, or slightly fragrant, but mixed with a subtle chemical smell. Although it is not pungent, it is also different from ordinary floral and fruity, just like the intertwined taste of nature and artificial craftsmanship.
When it comes to boiling point, the boiling point of this compound varies slightly according to environmental conditions and is roughly in a certain temperature range. When the external pressure is standard atmospheric pressure, its boiling point is in a certain temperature range, which allows the molecule to obtain enough energy to break free from the liquid phase and rise into a gaseous state. The characteristics of this boiling point are of great significance in chemical operations such as separation and purification, and can be an important reference for experimenters to control the timing of separation.
Besides the melting point, its melting point is also a specific value. At temperatures below the melting point, the molecules are arranged in a tight and orderly manner and exist in a solid state, just like an army waiting for it. When the temperature gradually rises to the melting point, the molecular thermal motion intensifies, the lattice structure begins to disintegrate, and the substance slowly transitions from solid to liquid. This melting point characteristic provides a strong basis for identifying the purity of the substance.
Its density is also an inherent property, and each unit volume has a certain mass. This density value can help the experimenter to accurately control the proportion of each component when formulating solutions and mixed substances, ensuring the accuracy of the experimental results. And because of its density characteristics, in stratification, extraction and other operations, it can be used to judge the stratification of the substance and other solvents, providing an important guide for chemical separation operations.
ETHYL 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE exhibits good solubility in organic solvents. For example, in common organic solvents such as ethanol and ether, like fish entering water, it can quickly disperse and dissolve to form a uniform solution. This solubility facilitates its use in organic synthesis reactions, enabling full contact between reactants, speeding up the reaction process, and promoting the smooth progress of various complex organic synthesis reactions. It is widely used in the field of organic chemistry.
What is the market outlook for ETHYL 4-ISOPROPYLTHIAZOLE-2-CARBOXYLATE?
ETHYL 4 - ISOPROPYLTHIAZOLE - 2 - CARBOXYLATE, that is, 4 - isopropylthiazole - 2 - carboxylic acid ethyl ester, this compound has emerged in the chemical and pharmaceutical fields and has broad prospects.
In the chemical industry, it is often a key intermediate in organic synthesis. With the rapid development of fine chemicals, the demand for many new materials and chemicals has surged. 4 - isopropylthiazole - 2 - carboxylic acid ethyl ester can participate in a variety of organic reactions due to its unique structure and chemical properties, and is used to synthesize compounds with special structures and functions, such as fragrances and pesticides with specific structures. For example, when synthesizing a new type of fragrance, it can go through a specific reaction path to build a unique fragrance skeleton, which brings new opportunities to the fragrance industry. And with the continuous optimization of the chemical process, its synthesis efficiency is improved, the cost is reduced, and the market supply is expected to increase, and the application field may be further expanded.
In the field of medicine, it has potential medicinal value. Scientists have found that its structure is similar to some active pharmaceutical ingredients, and it can be modified and modified to develop new drugs. For example, in the development of antibacterial drugs, this is used as a starting material to optimize the structure through multi-step reactions, or to develop new antibacterial drugs with high inhibitory effect on specific pathogens. At present, the research and development of new drugs is high, and there is a large demand for potential compounds. 4-isopropylthiazole-2-carboxylate ethyl ester, as a potential drug lead compound, has attracted the attention of many pharmaceutical companies and scientific research institutions. However, its development into actual drugs requires a large number of pharmacological experiments, clinical trials and other links. Although it is full of challenges, once successful, the market value is immeasurable.
In summary, 4-isopropylthiazole-2-carboxylate ethyl ester has considerable market prospects in both chemical and pharmaceutical fields. With in-depth research and technological progress, it is expected to shine in more fields and create huge economic value.