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What is the main use of 1 - ethyl - 6,7,8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester
Ethyl 1-ethyl-6,7,8-trifluoro-4-oxyquinoline-3-carboxylate is an important intermediate in organic synthesis and has a wide range of uses in the field of medicinal chemistry.
It has made many achievements in the creation of antibacterial drugs. Due to its unique chemical structure, it can effectively inhibit bacterial DNA rotatase and topoisomerase IV, which play a key role in bacterial DNA replication, transcription and repair. By inhibiting these two enzymes, the compound can successfully block the normal metabolism of bacterial DNA, thereby inhibiting bacterial growth and reproduction, and exerting significant antibacterial effects. In the synthesis of many quinolone antimicrobial drugs, it is often used as a starting material. After ingenious derivatization reactions, the drugs are endowed with better antibacterial activity, broader antibacterial spectrum and better pharmacokinetic properties.
Furthermore, in the field of pesticide research and development, it has also made a name for itself. With its mechanism of action on specific target enzymes, high-efficiency pesticides can be developed against certain pests or plant pathogens. Its mode of action either interferes with the normal physiological metabolism of pests or pathogens, or destroys their cell structure and function, achieving the purpose of controlling pests and diseases, helping agriculture to produce a bumper harvest, and may be more selective and less environmentally toxic than traditional pesticides.
And because its structure contains specific functional groups and conjugated systems, it also has potential in the field of materials science. Or it can be used to prepare functional materials with special optical and electrical properties, such as organic Light Emitting Diode (OLED) materials, photochromic materials, etc., injecting new vitality into the development of materials science.
In short, 1-ethyl-6,7,8-trifluoro-4-oxyquinoline-3-carboxylate ethyl ester is an indispensable and important compound in many fields such as medicine, pesticides and materials science. Its research and application prospects are broad, and it is of great significance to promote technological progress and innovation in related fields.
1 - ethyl - 6,7,8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester
1. ** Preparation of raw materials **: To prepare 1-ethyl-6,7,8-trifluoro-4-oxyquinoline-3-carboxylic acid ethyl ester, the corresponding starting materials need to be prepared. Usually suitable fluorine-containing aromatic compounds, ethyl-containing reagents and carboxyl and carbonyl functional group raw materials are used as starting materials. If a specific fluorobenzene derivative is used, this is the base material for introducing 6,7,8-trifluoro groups, and an ethyl halide or alcohol is required to introduce ethyl groups.
2. ** Reaction Steps **:
- ** Step 1: Cyclization Reaction **: Mix fluorinated aromatic raw materials with reagents with appropriate active groups, add suitable catalysts to a specific organic solvent. For example, use a base such as potassium carbonate as a catalyst, and heat it up to a certain temperature in a solvent such as acetonitrile to cause nucleophilic substitution and cyclization to occur to construct the prototype of a quinoline ring. This process requires precise temperature control and time control to ensure that the reaction proceeds according to the expected path and prevent side reactions from breeding. < Br > - ** The second step: ethylation reaction **: The first step is to separate and purify the product, and then put in ethyl-containing reagents, such as bromoethane, etc. In an alkaline environment, with the help of phase transfer catalysts such as tetrabutylammonium bromide, nucleophilic substitution occurs, and ethyl is introduced at the 1 position of the quinoline ring. This step also has strict requirements on the reaction conditions. The strength, dosage, reaction temperature, and time of the base all affect the ethylation effect.
- ** The third step: carbonylation and esterification **: The ethylation product, and then carbonylation and esterification with carbon monoxide and ethanol under the action of catalysts, form 4-oxo and 3-carboxylic acid ethyl ester structures. Commonly used catalysts, such as palladium-based catalysts, promote reactions under specific pressure and temperature. This step needs to be completed in a specific reaction device, and the pressure and temperature are precisely regulated to achieve the best reaction yield and selectivity.
3. ** Product Purification **: After the reaction is completed, the mixture is separated and purified through a series of operations. First, by extraction, the product is extracted from the reaction system with a suitable organic solvent such as ethyl acetate, and most of the water-soluble impurities are removed. After column chromatography, silica gel was used as the stationary phase, and the mixture of n-hexane and ethyl acetate was used as the mobile phase to further separate impurities and obtain pure 1-ethyl-6,7,8-trifluoro-4-oxyquinoline-3-carboxylic acid ethyl ester. Finally, by recrystallization method, an appropriate solvent was selected, such as ethanol-water mixed solvent, to further improve the purity of the product.
What are the physical and chemical properties of 1 - ethyl - 6,7,8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester
1 + - ethyl - 6, 7, 8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester, this is an organic compound, or it can be called fluoroquinoline carboxylate substances. Looking at its molecular structure, it has a quinoline mother nucleus, and there are fluorine atoms, carbonyl groups and ester groups connected at specific positions, which endows it with unique physical and chemical properties.
In terms of its physical properties, it is a solid under normal conditions, because it contains multiple aromatic rings and polar groups, the intermolecular force is strong. Melting point or higher, because the molecules are closely arranged, more energy is required to destroy the lattice. As for the solubility, due to the ester group and polar aromatic ring, it may have a certain solubility in organic solvents such as ethanol and acetone, but the solubility in water may be limited, because the overall polarity is not enough to fully interact with water.
In terms of chemical properties, the ester group makes it possible to hydrolyze. Under acidic or basic conditions, ester bonds can be broken, and hydrolysis under acidic conditions produces corresponding carboxylic acids and alcohols; hydrolysis under alkaline conditions is easier to proceed, generating carboxylic salts and alcohols. In addition, although the fluorine atoms on the quinoline ring have high electronegativity, the electron cloud density of the aromatic ring is reduced, and the activity of electrophilic substitution reaction may be slightly reduced, nucleophilic substitution reaction can still occur, especially under appropriate conditions, fluorine atoms can be replaced by other nucleophilic reagents. The presence of carbonyl groups also allows the compound to participate in reactions such as nucleophilic addition, such as reacting with nucleophiles containing active hydrogen to generate corresponding addition products.
1 - ethyl - 6,7,8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester
I look at what you said "1 - + - ethyl - + 6,7,8 - + trifluoro - + 4 - + oxoquinoline - + 3 - + carboxylate ethyl ester", which is the name of the chemical substance. However, it is not easy to know its price in the market.
Because the market price often varies with many factors, one of which is the state of supply and demand. If the demand for this product is wide and the supply is small, the price will be high; on the contrary, if the supply exceeds the demand, the price may drop. The second is related to the cost of production. The price of raw materials, the simplicity of the process, and the amount of energy consumption all affect the cost, which in turn affects the price. Third, market competition is also the key. If the competition in the same industry is intense, it is to compete for shares or reduce prices.
And the price of this chemical varies depending on its use. For scientific research, or due to low usage and high requirements, the price is not low; for industrial production, if the quantity is large, the price may vary due to scale effect.
However, it is difficult for me to determine the specific price. To get an accurate price, you can consult chemical product suppliers, distributors, or check chemical product trading platforms to know the approximate current market price.
1 - ethyl - 6,7,8 - trifluoro - 4 - oxoquinoline - 3 - carboxylate ethyl ester
1-Ethyl-6,7,8-trifluoro-4-oxyquinoline-3-carboxylate ethyl ester This product is related to safety and needs to be used with caution.
When handling this product, it must be carried out in a well-ventilated place. Because of its or hazardous ingredients, if the ventilation is not smooth, the gas will accumulate, which may cause poisoning and harm people's lives. Operators should also wear protective clothing, goggles and gloves, and be fully protected to prevent skin and eyes from contact and corrosion.
When storing, it should be placed in a cool, dry place away from fire and heat sources. Do not mix with oxidants, acids, alkalis, etc., to prevent violent reactions and cause explosions. At the same time, the storage place should be equipped with suitable materials to contain leaks, just in case.
The handling process should not be underestimated. It should be handled lightly and unloaded lightly. Do not operate brutally, so as not to damage the packaging and cause material leakage. If a leak occurs inadvertently, the surrounding personnel should be evacuated immediately, the leakage area should be isolated, and irrelevant personnel should be strictly prohibited from approaching. Emergency responders need to wear full masks and chemical protective clothing. Use inert materials such as sand and vermiculite to absorb leaks, collect them properly, and hand them over to professional institutions for treatment.
Furthermore, the disposal of this object should also follow relevant laws and regulations, and should not be discarded at will. It should be handed over to a qualified unit and handled in a professional manner to avoid harm to the environment and person. Anyone involved in this object should be treated with caution, fully protected, and operated in accordance with regulations, so that the security is safe.