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What is the main use of Benzeneacetonitrile, 3-Chloro-4-Fluoro-?
3-Chloro-4-fluorophenylacetonitrile has a wide range of uses. It is a crucial raw material in the field of pharmaceutical synthesis. Many drugs are created, and they are often relied on to build key structural units. Due to the unique properties of chlorine and fluorine atoms in molecules, the physical, chemical and biological activities of compounds can be significantly improved. In the eyes of drug developers, it is a valuable modification check point. For example, in the preparation of specific anti-cancer drugs, 3-chloro-4-fluorophenylacetonitrile can be introduced into a specific molecular framework through delicate chemical reactions to help improve the targeting and inhibitory efficacy of drugs on cancer cells, which is a powerful "weapon" for the development of anti-cancer drugs.
In the field of pesticide creation, it is also an indispensable ingredient. Today's pesticides pursue high efficiency, low toxicity and strong selectivity, and 3-chloro-4-fluorophenylacetonitrile can meet these many needs. Its unique chemical structure allows the prepared pesticides to be highly active to specific pests or weeds, while having little impact on the environment and non-target organisms. For example, the research and development of new herbicides, incorporating this compound, can optimize the herbicide efficiency, accurately combat weeds, protect the growth of crops, and escort the harvest of agriculture.
Furthermore, in the field of materials science, it has also made a name for itself. Due to the special electronic effects of chlorine and fluorine, materials containing 3-chloro-4-fluorobenzene acetonitrile structures may have unique electrical, optical and thermal properties. For example, in the synthesis of some organic optoelectronic materials, the introduction of this structure is expected to improve the charge transfer and luminous efficiency of materials, contributing to the development of new display technologies and optoelectronic devices.
What are the physical properties of Benzeneacetonitrile, 3-Chloro-4-Fluoro-?
3-Chloro-4-fluorophenylacetonitrile, this material has different properties, let me tell you in detail.
Under normal conditions, it is either a colorless to slightly yellow liquid, or a crystalline solid with a uniform texture and no variegated or foreign matter. Smell its smell, or have a specific smell, pungent or not, depending on the specific situation and individual perception.
When it comes to melting and boiling points, the values of melting point and boiling point vary depending on the ambient air pressure. In general, the melting point has its specific range. In this temperature range, the substance gradually melts from the solid state to the liquid state; the boiling point is also defined accordingly. When the temperature rises to the boiling point, the substance converts from the liquid state to the gaseous state.
Its solubility is also worthy of attention. In organic solvents, such as ethanol and ether, etc., it may exhibit good solubility and can be dissolved with it to form a uniform solution. However, in water, the solubility is poor or mixed with water. It can be seen that it is stratified. Due to its molecular structure characteristics, it is difficult to form a stable interaction with water molecules.
In terms of density, it also has its unique value compared with common organic solvents or water. This value reflects the mass per unit volume. In practical applications, it is related to many operation details. For example, in the process of mixing and separation, the difference in density is an important consideration.
In addition, the stability of 3-chloro-4-fluorobenzene acetonitrile may remain relatively stable under normal conditions. However, under special conditions such as high temperature, open flame, and strong oxidant, chemical reactions may occur, causing structural changes and forming new substances. This is something that needs special attention during storage and use.
Benzeneacetonitrile, what are the chemical properties of 3-Chloro-4-Fluoro-
3-Chloro-4-fluorophenylacetonitrile, this material has unique chemical properties. Its appearance is usually colorless to light yellow liquid, and its properties are relatively stable. However, under certain conditions, it can also show active reactivity.
From a structural perspective, the benzene ring gives it a certain conjugation stability, and the introduction of chlorine and fluorine atoms greatly changes the electron cloud distribution of the molecule. Fluorine atoms are extremely electronegative, which decreases the density of the ortho-electron cloud and causes changes in the electrophilic substitution reaction activity on the benzene ring. Although the electronegativity of chlorine atoms is slightly inferior to that of fluorine, it also affects the electron cloud of the benzene ring. The synergy between the two makes the molecular chemical activity unique.
In terms of reactivity, the nitrile group is a key activity checking point. It can be hydrolyzed under various conditions and gradually converted into carboxylic acids in acidic media; in alkaline environments, carboxylate is formed. In addition, the nitrile group can be converted into an amine group by reduction reaction, providing a variety of paths for organic synthesis.
At the same time, the halogen atom on the benzene ring can participate in nucleophilic substitution reactions. Under appropriate nucleophilic reagents, bases and solvents, chlorine or fluorine atoms can be replaced by other groups to construct more complex organic molecular structures, which have important application potential in the fields of medicinal chemistry, materials science and other fields.
What is the production method of Benzeneacetonitrile, 3-Chloro-4-Fluoro-?
The method of preparing 3-chloro-4-fluorobenzene acetonitrile can be done in the following ways.
First, start with 3-chloro-4-fluorobenzoic acid. First, make it thioyl chloride to obtain 3-chloro-4-fluorobenzyl chloride. In this step, thioyl chloride is chlorinated, and the two reactions are strong, and it needs to be controlled to escape sulfur dioxide chlorination. And the obtained benzyl chloride needs to be refined.
times, to obtain 3-chloro-4-fluorobenzyl chlorocyanide or cyanide in solution, such as dimethylformamide. This reaction can be made in an inert atmosphere, and with the help of catalysis such as phase shift catalysis, in order to make the cyanochlorine atom, 3-chloro-4-fluorobenzene acetonitrile. However, cyanide is toxic, and the operation needs to be completed, and the mixture should also be properly handled.
Second, start with 3-chloro-4-fluorobromobenzene. First, it is reversed in the water ether to obtain Grignard 3-chloro-4-fluorophenyl bromide. This step requires water, because Grignard decomposes in contact with water.
Then, 3-chloro-4-fluorophenyl bromide acetonitrile is reversed, and acidified and hydrolyzed, and 3-chloro-4-fluorophenylacetonitrile can also be obtained. The raw material phase used in this way is easy to obtain, but Grignard's reaction parts are harsh, and ether is flammable. It needs to be controlled and operated to ensure safety.
Or, start with 3-chloro-4-fluoroaniline, and use nitric acid for low-temperature treatment to obtain diazonium. Then make the diazonium cyanide and Sander, and replace the diazonium group with cyanyl to obtain 3-chloro-4-fluorophenylacetonitrile. This step is a little more complicated, the diazonation reaction needs to be controlled, and the cyanide reaction is also toxic, so it must be handled with caution.
Where this method has its own advantages and disadvantages, it needs to be weighed according to the availability of raw materials, cost, and safety factors.
Benzeneacetonitrile, 3-Chloro-4-Fluoro - What are the precautions when using
When using 3-chloro-4-fluorophenylacetonitrile, many things should be paid attention to. This is a highly toxic product, which can be life-threatening when touched, smelled or taken by mistake. During operation, be sure to wear protective clothing, goggles and gloves, and do it in a well-ventilated place to prevent gas inhalation.
Furthermore, it is chemically active and can easily cause combustion and explosion in case of fire, hot topic or oxidant. Therefore, it should be kept away from fire and heat sources and kept separate from oxidants. When storing, it should be placed in a cool, dry and well-ventilated place, tightly sealed, and stored in a cool place away from light to prevent deterioration.
In addition, if you accidentally come into contact with the skin or eyes during use, you need to rinse with plenty of water immediately and seek medical attention in time. In case of leakage, personnel in the contaminated area of the leakage should be quickly evacuated to a safe area, quarantined, and access should be strictly restricted. Emergency responders need to wear protective equipment and do not let leaks come into contact with combustible substances. Small leaks can be absorbed by inert materials such as sand and vermiculite. For large leaks, embankments or pits should be built to contain them, covered with foam, to reduce steam disasters. After treatment, the contaminated area must be properly cleaned to avoid residual hazards. In short, the use of 3-chloro-4-fluorobenzene acetonitrile must be done with caution and in strict accordance with safety procedures to ensure the safety of personnel and the environment.