Chemical Formula | C8H3F N2O4 |
Molar Mass | 210.12 g/mol |
Appearance | Solid |
Chemical Formula | C8H3F N2O4 |
Molecular Weight | 210.12 |
Appearance | Solid (predicted) |
Boiling Point | 322.2°C at 760 mmHg (predicted) |
Melting Point | 105 - 107°C |
Density | 1.546 g/cm³ (predicted) |
Vapor Pressure | 2.23E - 05 mmHg at 25°C (predicted) |
Logp | 1.73 (predicted) |
Solubility | Insoluble in water (predicted) |
Flash Point | 148.7°C (predicted) |
Chemical Formula | C8H3FN2O4 |
Molecular Weight | 210.12 |
Appearance | Solid (usually a powder or crystalline solid) |
Physical State At Room Temperature | Solid |
Odor | Typically odorless or very faint odor |
Solubility In Water | Low solubility in water |
Solubility In Organic Solvents | Soluble in some organic solvents like dichloromethane, chloroform |
Melting Point | 138 - 142 °C (reported range) |
Boiling Point | Decomposes before boiling |
Density | Data may vary, typically around 1.5 - 1.6 g/cm³ (estimated for similar aromatic nitrile compounds) |
What are the chemical properties of 4-Fluorobenzene-1,2-dinitrile?
4-Fluorobenzene-1,2-dinitrile is a kind of organic compound. Its chemical properties are unique, with the characteristics of a nitrile group and a fluorine atom.
The presence of a nitrile group makes this substance have a certain chemical activity. The nitrile group can be hydrolyzed, and it is gradually converted into a carboxyl group under the catalysis of an acid or a base. When the alkali catalyzes hydrolysis, a carboxylic acid can be obtained by first forming a carboxylic acid. This hydrolysis reaction is often used in organic synthesis to prepare carboxyl-containing compounds. Nitrile groups can also be reduced and treated with specific reducing agents, which can be converted into amine groups, which are quite useful in the construction of nitrogen-containing organic molecules.
Furthermore, the fluorine atom in the molecule has a The fluorine atom has high electronegativity, causing the C-F bond to have strong polarity. This polarity changes the physical and chemical properties of the molecule, such as improving molecular stability and fat solubility. In the nucleophilic substitution reaction, although the fluorine atom has a weaker tendency to leave than other halogen atoms, due to the polarity of the C-F bond, the reactivity and selectivity can be affected.
The benzene ring of 4-fluorobenzene-1,2-dinitrile, as a conjugated system, can undergo electrophilic substitution reaction. Due to the localization effect of fluorine atoms and nitrile groups, electrophilic reagents attack specific positions of the benzene ring. This reactivity enables the compound to be electrophilically substituted and other functional groups are introduced to expand its application in the field of organic synthesis.
In summary, 4-fluorobenzene-1,2-dinitrile is rich in chemical properties due to the interaction of nitrile groups, fluorine atoms and benzene rings, and has broad application prospects in organic synthesis, medicinal chemistry and other fields.
What are the synthesis methods of 4-Fluorobenzene-1,2-dinitrile?
The synthesis method of 4-fluorobenzene-1,2-dinitrile is quite complicated and requires an exquisite method. In the past, fluorine-containing benzene derivatives were mostly used as the starting materials, supplemented by specific reaction conditions and reagents, and gradually converted.
One method is to use 4-fluorobenzaldehyde as the starting material. First, it is combined with cyanide reagents, such as sodium cyanide, in a suitable solvent, catalyzed by a base, and nucleophilic addition reaction is carried out to obtain 4-fluorobenzonitrile derivatives. Then, the derivative is given a nitrifying reagent, such as a mixed acid of concentrated nitric acid and concentrated sulfuric acid. Under low temperature and carefully controlled conditions, nitro groups are introduced into the ortho-position of the benzene ring. After many reaction steps, 4-fluorobenzene-1,2-dinitrile is finally obtained. In this process, each step of the reaction requires precise control of the reaction temperature, time and reagent dosage to prevent side reactions from occurring.
Another method uses fluorine-containing halogenated benzene as the starting material. First, a metal reagent, such as magnesium, is used to make a Grignard reagent, and then reacts with nitriles to construct a benzene ring structure containing nitrile groups. After that, the nitro group is also introduced at a specific position in the benzene ring by means of nitration reaction. Through a multi-step carefully designed reaction, the synthesis of 4-fluorobenzene-1,2-dinitrile can also be achieved. In this path, the preparation of Grignard reagents requires harsh conditions of anhydrous and oxygen-free, and subsequent reactions also need to be finely adjusted to achieve the ideal yield and purity.
In addition, catalytic reactions are also used. The coupling reaction catalyzed by transition metal catalysts, such as palladium and copper, can cleverly connect fluorine-containing aromatic hydrocarbons with reagents containing nitrile groups and nitro groups, and synthesize the target product in a more efficient and selective way. However, this kind of catalytic reaction requires high requirements for the activity of the catalyst, the selection of ligands, and the optimization of the reaction system, which requires researchers to explore in detail in order to find the best reaction conditions and make the synthesis process efficient and economical.
What is the main use of 4-Fluorobenzene-1,2-dinitrile?
4-Fluorobenzene-1,2-dinitrile is one of the organic compounds. Its main uses are quite extensive and it has important applications in many fields.
First, in the field of pharmaceutical chemistry, this compound is often a key intermediate. Pharmaceutical synthesis is like a delicate skill, and the preparation of many drugs requires specific intermediates as the cornerstone. 4-Fluorobenzene-1,2-dinitrile With its unique chemical structure, it can participate in a series of complex chemical reactions, and then construct molecular structures with specific pharmacological activities. For example, in the development of new drugs targeting specific disease targets, this compound can be used as a starting material to convert into therapeutic drug molecules through multi-step reactions, contributing to human health.
Second, in the field of materials science, 4-fluorobenzene-1,2-dinitrile also shows unique value. With the advancement of science and technology, the demand for special performance materials is increasing day by day. This compound can be used to prepare high-performance polymer materials. The fluorine atoms and dinitrile groups in its structure endow the material with special physical and chemical properties, such as enhancing the stability, heat resistance and mechanical properties of the material. Such materials based on 4-fluorobenzene-1,2-dinitrile can play a key role in enabling related industries to move to a higher level, such as in the manufacturing of components for electronic equipment or in the demand for high-performance materials in the aerospace field.
Third, in the field of organic synthetic chemistry, this compound is like a "master key", opening the door to many novel reactions. Chemists use it as a basis to explore various new chemical reaction paths and expand the boundaries of organic synthesis. By ingeniously designing reaction conditions and reagent combinations, using the activity check point of 4-fluorobenzene-1,2-dinitrile, the construction of various complex organic molecules can be realized, injecting continuous vitality into the development of organic chemistry.
4-Fluorobenzene-1,2-dinitrile What are the precautions during storage and transportation?
For 4-fluorobenzene-1,2-dinitrile, many matters need to be paid attention to during storage and transportation.
Its nature or chemical activity, when storing, the first environment is dry. Cover moisture can easily cause chemical reactions and damage its quality. Therefore, choose a dry and well-ventilated place to avoid moisture.
Temperature is also critical. Excessive temperature may cause it to decompose, evaporate, or cause dangerous reactions; too low temperature may change its properties. It is necessary to control it in a suitable temperature range, often in a cool place.
Furthermore, this substance may be toxic and irritating. The place of storage should be far away from the place where people and animals often go, and it should be clearly marked to indicate its dangerous nature, so that everyone can know and avoid it.
When transporting, the packaging must be sturdy. Choose suitable packaging materials to prevent leakage and collision. If the packaging is damaged, the leaked substances may endanger the transporters and the surrounding environment.
The means of transportation must also be clean, free of other chemical residues, so as to avoid cross-contamination and adverse reactions.
The escort should be aware of its nature and emergency measures. In case of emergencies on the way, such as leakage, appropriate measures can be taken quickly to minimize harm.
In short, the storage and transportation of 4-fluorobenzene-1,2-dinitrile has strict requirements in terms of environment, packaging, personnel, etc., and it is necessary to be careful to ensure safety.
What are the effects of 4-Fluorobenzene-1,2-dinitrile on the environment and human health?
4 - Fluorobenzene - 1,2 - dinitrile is an organic compound that has an impact on the environment and human health.
At the environmental level, once it enters the natural environment, it is difficult to be decomposed by microorganisms due to its stable chemical structure and is easy to accumulate in the environment. If released into the soil, it will change the soil physical and chemical properties, affect the structure and function of microbial communities in the soil, and then interfere with the nutrient absorption and growth and development of plants. If it flows into the water body, it will cause toxicity to aquatic organisms and destroy the balance of aquatic ecosystems. For example, it will affect the physiological processes such as fish respiration and reproduction, and reduce the number and diversity of aquatic organisms.
In terms of human health, this substance is toxic to some extent. Inhalation through the respiratory tract can irritate the mucosa of the respiratory tract, causing symptoms such as cough and asthma, and long-term inhalation or lung damage. Contact through the skin may enter the human body through the skin barrier, resulting in skin allergies, redness, swelling, itching and other contact dermatitis symptoms. If accidentally ingested, it will damage the digestive system, cause nausea, vomiting, abdominal pain, etc., and even life-threatening in severe cases. In addition, animal experiments have shown that long-term exposure to the environment containing such substances may have teratogenic and carcinogenic latent risks, affecting human genetic materials, causing gene mutations and cell carcinogenesis.
Therefore, when producing and using products containing 4-Fluorobenzene-1,2-dinitrile, it is necessary to take strict protective and treatment measures to reduce its harm to the environment and human health.