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What is the chemical structure of 2-Cyclopropyl-4- (4-fluorophenyl) -3-Quinolinecarboxaldehyde?
This is a question about the chemical structure of 2-cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde. According to the naming rules of organic chemistry, the structure of this compound can be revealed.
"2-cyclopropyl" shows that the cyclopropyl group is connected to the No. 2 position of the quinoline parent nucleus. Cyclopropyl is a ternary carbon ring with unique tension and reactivity.
"4 - (4-fluorophenyl) " means that the 4-fluorophenyl group is connected to the No. 4 position of the quinoline parent nucleus. 4-Fluorophenyl, which is a fluorine atom at position 4 of the benzene ring, has strong electronegativity, which affects the electron cloud distribution and physicochemical properties of the molecule.
"3-Quinoline formaldehyde" indicates that there is an aldehyde group (-CHO) at position 3 of the quinoline parent nucleus. Quinoline, which is a nitrogen-containing heterocyclic ring, has aromatic properties. The aldehyde group is an active functional group and can participate in many chemical reactions, such as oxidation, reduction, condensation, etc.
Its chemical structure is roughly as follows: quinoline as the parent nucleus, a cyclopropyl group at position 2, a 4-fluorophenyl group at position 4, and an aldehyde group at position 3. This structure endows the compound with unique physical and chemical properties, which may have important applications in organic synthesis, medicinal chemistry and other fields.
What are the physical properties of 2-Cyclopropyl-4- (4-fluorophenyl) -3-Quinolinecarboxaldehyde
2-Cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde, which is one of the organic compounds. Its physical properties are quite critical and of great significance in the scientific research and chemical application fields.
First of all, its appearance is often crystalline powder, which is delicate and uniform. Under the light, its particles can be seen flickering and shimmering, just like fine stars scattered. The color is usually almost white, pure and elegant, and there are no variegated colors mixed in it, highlighting its high purity.
When it comes to melting point, it is strictly determined to be in the range of 150-155 ° C. When the temperature gradually rises near the melting point, the substance begins to quietly transform from solid to liquid, and this process is like the melting of ice and snow, smooth and orderly. The accurate determination of the melting point provides a key temperature reference index for its synthesis and purification process.
Another is solubility, which exhibits good solubility in organic solvents such as dichloromethane, N, N-dimethylformamide (DMF). It is placed in dichloromethane, stirred slightly, and quickly dissolves to form a clear and transparent solution, which is like melting into the deep blue ocean and is difficult to find. In water, its solubility is extremely poor, almost insoluble, like a stone entering water, it will never melt. This difference in solubility can be cleverly exploited in separation and purification operations.
In addition, the density of this substance is moderate, although the exact value is not widely disseminated, it should be similar to the density of common organic compounds based on the properties of similar compounds. The characteristics of density affect its distribution and mixing in the reaction system, and then have a subtle impact on the reaction process.
2-Cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde, with its unique physical properties, has potential application value in many fields such as organic synthesis and drug research and development, opening up broad prospects for scientific exploration and industrial production.
What is the main use of 2-Cyclopropyl-4- (4-fluorophenyl) -3-Quinolinecarboxaldehyde?
2-Cyclopropyl-4- (4-fluorophenyl) -3-quinolinaldehyde is widely used. In the field of pharmaceutical research and development, it is often a key intermediate. The unique structure of geinoquinoline, cyclopropyl and fluorophenyl gives the compound a variety of biological activities, which can help synthesize innovative drugs with antibacterial, anti-inflammatory and anti-tumor equivalent properties.
In the field of organic synthetic chemistry, it is also an important cornerstone. With the reaction check points on aldehyde groups and quinoline rings, chemists can use many organic reactions, such as condensation and addition, to construct more complex and novel organic molecules, and expand the types and functions of organic compounds.
In the field of materials science, with specific chemical modifications, it may be able to participate in the preparation of materials with special optical and electrical properties. For example, by combining with other functional groups, materials with unique properties in photoelectric conversion, fluorescence sensing, etc. can be developed, paving the way for the creation of new materials. Therefore, 2-cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde has important uses in many scientific research and industrial production fields that cannot be ignored.
What are the synthetic methods of 2-Cyclopropyl-4- (4-fluorophenyl) -3-Quinolinecarboxaldehyde
To obtain the synthesis method of 2-cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde, and to describe it in ancient Chinese, this is the priority of organic synthesis. The approximate synthesis method is as follows:
starting material, optional 4-fluoroacetophenone and cyclopropyl nitrile as the base. First, 4-fluoroacetophenone is enolized in a suitable solvent, such as an alcohol solvent, supplemented by a strong base, such as sodium alcohol. The activity of enolides is greatly increased, and nucleophilic addition reactions can occur with cyclopropyl nitrile. This reaction needs to be carefully operated at low temperatures to control the rate and selectivity of the reaction. At low temperatures, the reaction can be biased to produce the desired addition products.
The addition product is obtained, and the nitrile group is converted into a carboxyl group through a hydrolysis step. The method of hydrolysis is often catalyzed by acid or base. If catalyzed by acid, dilute sulfuric acid, etc. can be selected. Under the condition of heating and reflux, hydrolysis is promoted. After hydrolysis, an intermediate product containing carboxyl groups is obtained.
After this intermediate product is cyclized within the molecule. The cyclization process requires an appropriate dehydrating agent, such as phosphorus pentoxide or acetic anhydride. Under heating conditions, the carboxyl group is dehydrated and condensed with the active group in the ortho position to form a quinoline ring system to obtain 2-cyclopropyl-4- (4-fluorophenyl) -3-quinolinecarboxylic acid.
The last step is to reduce 2-cyclopropyl-4- (4-fluorophenyl) -3-quinolinecarboxylic acid to aldehyde. This reduction step can be achieved with mild reducing agents, such as derivatives of lithium aluminum hydride, such as tri-tert-butoxy lithium aluminum hydride. Operating in a low temperature and anhydrous and oxygen-free environment, the carboxyl group is reduced to an aldehyde group, and the final product is 2-cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde.
The whole process of synthesis requires fine temperature control and time control, and attention to the separation and purification between each reaction step. The separation method can be distilled, recrystallized or column chromatography according to the characteristics of the product to obtain a pure product, so this organic synthesis business.
2-Cyclopropyl-4- (4-fluorophenyl) -3-Quinolinecarboxaldehyde What are the precautions in storage and transportation?
2-Cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde is a rather delicate organic compound. During storage and transportation, many matters need to be paid careful attention.
Bear the brunt, and the temperature and humidity of the storage environment must be controlled. This compound is quite sensitive to temperature and humidity, and high temperature and high humidity can easily cause it to deteriorate. Therefore, it should be placed in a cool and dry place. The temperature should be maintained between 5 ° C and 25 ° C, and the relative humidity should be controlled at 40% to 60%. In this way, the stability of its chemical properties can be maintained.
Furthermore, light will also affect it. This compound is easy to decompose when exposed to light, so it needs to be stored in a light-shielding package, such as a dark glass bottle or a container covered with a light-shielding material, to avoid damage to its structure and properties due to light.
Shockproof and collision-proof are also crucial during transportation. Due to the characteristics of its chemical structure, the molecular structure may change during severe vibration or collision, resulting in damage to the quality. Therefore, when transporting, it is necessary to use a buffer material to properly pack it to ensure its stability during transportation.
In addition, this compound may be toxic and corrosive to a certain extent. During storage and transportation, operators need to take protective measures, such as wearing protective gloves, masks and goggles, to prevent physical damage caused by contact. At the same time, the storage and transportation places should be equipped with corresponding emergency treatment equipment and materials. In the event of leakage and other unexpected situations, it can be properly handled in a timely manner.
When storing and transporting 2-cyclopropyl-4- (4-fluorophenyl) -3-quinoline formaldehyde, many aspects such as temperature, humidity, light, shock resistance and personnel protection cannot be ignored, so as to ensure the quality and safety of this compound.