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What are the main uses of 2-Fluoro-Benzeneacetonitrile?
2-Fluorophenylacetonitrile, which has a wide range of uses. In the field of medicinal chemistry, it is a key synthetic raw material. Because fluorinated organic compounds are in drug molecules, they can significantly change the physical, chemical and biological properties of the compounds. Looking at many examples of drug development, the introduction of fluorine atoms can often enhance the binding ability of drugs to targets, improve the metabolic stability of drugs, and then improve the efficacy of drugs. 2-Fluorophenylacetonitrile can be converted into intermediates with specific pharmacological activities through a series of chemical reactions, and then cleverly spliced and modified to make drugs for the treatment of various diseases such as cardiovascular diseases and nervous system diseases.
In the field of pesticide chemistry, 2-fluoro-phenylacetonitrile also plays an important role. Modern pesticides pursue high efficiency, low toxicity and environmental friendliness, and fluorinated pesticides are in line with this trend. Starting from 2-fluoro-phenylacetonitrile, pesticides with high-efficiency insecticidal, bactericidal or herbicidal activities can be synthesized. Due to its unique chemical structure, it can precisely act on the specific physiological processes of pests, bacteria or weeds, achieving the purpose of efficient control, and has low toxicity to non-target organisms, reducing adverse effects on the environment.
Furthermore, in the field of materials science, 2-fluoro-phenylacetonitrile can participate in the synthesis of special organic materials. For example, in the preparation of organic optoelectronic materials, they can be used as structural units to introduce polymers or small molecule systems to regulate the electronic structure and optical properties of materials, providing a unique structural foundation for the development of new optoelectronic devices, such as organic Light Emitting Diodes (OLEDs), solar cells, etc., to help improve the performance and function of devices.
What are the physical properties of 2-Fluoro-Benzeneacetonitrile?
2-Fluorophenylacetonitrile, this substance is an important raw material for organic synthesis. Its physical properties are quite critical and are related to many practical applications.
Looking at its appearance, it is often in the form of a colorless to light yellow transparent liquid, like a clear jade liquid, which may flash in the sun. Smell it, it has a special smell. Although it is not fragrant, it has a unique logo, which can help identify this substance.
Talking about the melting point, it is between -20 ° C and -15 ° C, which is similar to the temperature limit of a cold night. At this low temperature, its shape may begin to change. The boiling point is in the range of 235 ° C to 240 ° C, and a higher temperature is required to make it boil and vaporize, as if breaking through a certain bondage and realizing a change in form.
The density of 2-fluorobenzene acetonitrile is about 1.15g/cm ³, which is heavier than water. If it is placed in one place with water, it is like a treasure that sinks under the water, quietly lying still. Its solubility also has characteristics, slightly soluble in water, as if it only maintains an elusive relationship with water, but it can be better dissolved in organic solvents such as ethanol and ether. In these solvents, it seems that a suitable habitat can be found, and it blends well with it.
In addition, its stability is acceptable under conventional conditions, but in extreme situations such as open flames and hot topics, there is also a risk of danger, just like under a calm lake or hidden undercurrents. When using it, you need to be cautious and not be negligent, so as not to cause unexpected changes.
What is the chemistry of 2-Fluoro-Benzeneacetonitrile?
2-Fluorine-phenylacetonitrile is a member of the family of organic compounds. It has unique chemical properties and is of great significance to the field of organic synthetic chemistry.
In this compound, the fluorine atom has unique characteristics, which significantly affects the overall properties of the molecule. Fluorine atoms have high electronegativity, and when they are connected to benzene rings and acetonitrile groups, they will have an effect on the distribution of molecular electron clouds. Due to the electron-withdrawing effect of fluorine atoms, the electron cloud density of the benzene ring decreases, which changes the activity of electrophilic substitution reactions on the benzene ring. Compared with similar compounds without fluorine, the 2-fluoro-phenylacetonitrile benzene ring is more difficult to undergo electrophilic substitution, because
The presence of acetonitrile groups also endows the compound with many important chemical properties. Acetonitrile groups can participate in a variety of chemical reactions, such as hydrolysis reactions. Under certain conditions, acetonitrile groups can be converted into carboxyl groups to generate 2-fluoro-phenylacetic acid. In addition, acetonitrile groups can also participate in reactions such as nucleophilic addition, providing the possibility to construct complex organic molecular structures. The chemical stability of
2-fluoro-phenylacetonitrile is also worthy of attention. The combination of fluorine atoms with benzene rings and acetonitrile groups makes the molecule have certain stability. However, under some extreme conditions, such as high temperature, strong acid or strong base environment, its structure may change. At high temperatures, intra-molecular rearrangement reactions may be initiated; in the presence of strong acids or bases, the substituents on the acetonitrile group or benzene ring may undergo corresponding transformation.
From the perspective of physical properties and chemical properties, the relative molecular weight and molecular structure of 2-fluoro-phenylacetonitrile determine that it has a certain boiling point and melting point. Its solubility, due to the fact that there are both hydrophobic phenyl ring parts and relatively hydrophilic acetonitrile groups in the molecule, has a certain solubility in organic solvents such as ethanol and ether, and relatively small solubility in water. This solubility characteristic also affects the environment and conditions in which it participates in chemical reactions. In organic synthesis, it is often necessary to choose a suitable reaction solvent according to its solubility to ensure the smooth progress of the reaction.
What is 2-Fluoro-Benzeneacetonitrile production method?
2-Fluorobenzyl acetonitrile, an important intermediate in organic synthesis, is widely used in the fields of medicine and pesticides. The common methods for its preparation have several ends.
One is to use 2-fluorobenzyl halide and cyanide as raw materials. In the past, 2-fluorobenzyl chloride or 2-fluorobenzyl bromide were commonly used to react with cyanides such as sodium cyanide and potassium cyanide in appropriate solvents. If N, N-dimethylformamide (DMF) is used as a solvent and heated and stirred, the nucleophilic substitution reaction can occur, and the halogen atom is replaced by a cyanyl group, thereby preparing 2-fluorobenzyl acetonitrile. However, cyanide is highly toxic, and the operation must be extremely cautious, and the by-products produced also need to be properly handled to avoid polluting the environment.
Second, 2-fluorobenzaldehyde is used as the starting material. Shilling 2-fluorobenzaldehyde and malonic acid are condensed in the presence of basic catalysts such as pyridine to obtain 2-fluorobenzene methylmalonic acid, and then decarboxylated to obtain 2-fluorobenzene acid. Subsequently, 2-fluorobenzene acetonitrile can be obtained by adding 2-fluorobenzene acid and hydrocyanic acid, and finally dehydrating. This route step is slightly complicated, but the raw material is relatively easy to obtain, and the direct use of highly toxic cyanide is avoided, which is slightly safer.
Third, the reaction with the help of transition metal catalysis. Using 2-fluorohalobenzene and acetonitrile as raw materials, in the presence of transition metal catalysts and ligands such as palladium and copper, the metal catalyst can activate the carbon-halogen bond of halobenzene, so that the carbon anion of acetonitrile can be coupled with it to form 2-fluorophenylacetonitrile. This method has mild reaction conditions and good selectivity, but the catalyst cost is high, which may limit its large-scale production.
All preparation methods have advantages and disadvantages. In actual production, the optimal method should be selected according to the comprehensive consideration of raw material availability, cost, safety, environmental protection and other factors to prepare 2-fluorophenylacetonitrile.
2-Fluoro-Benzeneacetonitrile to pay attention to when storing and transporting
2-Fluorophenylacetonitrile is a commonly used raw material in organic synthesis, which has certain toxicity and danger. When storing and transporting, be sure to pay attention to the following ends:
First, the storage environment should be carefully selected. It should be placed in a cool and ventilated warehouse, away from fire and heat sources, because the substance is prone to dangerous reactions when heated. The temperature of the warehouse should not exceed 30 ° C, and the relative humidity should not exceed 80%. And it should be stored separately from oxidants, acids, and alkalis, and must not be mixed to prevent dangerous interactions.
Second, the packaging must be tight. The packaging materials used must have good sealing properties to effectively prevent the leakage of 2-fluorophenylacetonitrile. It is usually packaged in galvanized iron or plastic drums. Warning signs should be clearly marked on the outside of the package, such as "toxic" and "flammable", so that the contact person can see the danger at a glance.
Third, the transportation process cannot be ignored. During transportation, it is necessary to ensure that the container does not leak, collapse, fall or damage. The means of transportation should have corresponding fire fighting equipment and leakage emergency treatment equipment. During transportation, it should be protected from sun exposure, rain and high temperature. If transported by road, it should be driven according to the specified route and do not stop in residential areas and densely populated areas.
Fourth, the operator should take protective measures. Whether it is handling during storage or loading and unloading before transportation, relevant personnel should wear self-priming filter gas masks (full masks), tape gas suits, and rubber gloves to avoid direct contact with 2-fluorobenzene acetonitrile and prevent poisoning or other injuries.
In short, the storage and transportation of 2-fluorobenzene acetonitrile requires attention from various aspects such as the environment, packaging, and operation, and strictly follows relevant safety regulations to ensure the safety of personnel and the environment is not polluted.