3 Cyano 4 Fluorobenzenesulphonyl Chloride
Fluorine Difluoride Fluorobenzene Fluorobenzyl Trifluorotoluene
3-Cyano-4-fluorobenzenesulphonyl chloride
Name 3-Cyano-4-fluorobenzenesulphonyl chloride
Chemical Formula C7H3ClFNO2S
Molar Mass 221.62 g/mol
Appearance Solid (usually)
Color Typically white to off - white
Odor Pungent, characteristic sulfonyl chloride odor
Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform
Reactivity Reactive towards nucleophiles, can undergo substitution reactions
Chemical Formula C7H3ClFNO2S
Molecular Weight 235.62
Appearance Solid (likely white to off - white)
Melting Point N/A (specific value needed for accurate entry)
Boiling Point N/A (specific value needed for accurate entry)
Density N/A (specific value needed for accurate entry)
Solubility In Water Insoluble (expected, due to non - polar groups)
Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform
Flash Point N/A (specific value needed for accurate entry)
Purity Typically expressed as a percentage (e.g., 95%, 98% etc.)
Stability Stable under normal conditions, but reactive with nucleophiles
Chemical Formula C7H3ClFNO2S
Molecular Weight 221.62
Appearance Typically a solid (but color may vary depending on purity)
Physical State At Room Temperature Solid
Solubility In Common Solvents Soluble in some organic solvents like dichloromethane, chloroform, less soluble in water
Melting Point Specific value would require experimental determination
Boiling Point Data may vary; needs experimental measurement
Density Exact value depends on measurement conditions
Reactivity Reactive towards nucleophiles due to the presence of sulfonyl chloride group
FAQ

What are the main uses of 3-Cyano-4-fluorobenzenesulphonyl chloride?

3-Cyano-4-fluorobenzenesulfonyl chloride is an important raw material for organic synthesis and has a wide range of uses.

In the synthesis of medicine, it can be used as a key intermediate. Due to the structure of cyanide and fluorine atoms, compounds are endowed with unique biological activities. By reacting with other organic molecules, a compound structure with specific pharmacological activities can be constructed. For example, when developing new antibacterial drugs, it is used as a starting material. After multi-step reaction, cyano and fluorobenzenesulfonyl chloride are partially ingeniously fused into drug molecules, which may enhance the effect of drugs on bacterial cell walls or specific enzymes and improve antibacterial efficacy.

It also plays an important role in the creation of pesticides. The properties of cyano and fluorine atoms can endow pesticides with good biological activity and environmental adaptability. Using them as basic raw materials, synthetic pesticides may be highly selective to specific pests, which can precisely attack pests and have little impact on the environment. For example, the synthesis of new insecticides can optimize the ability to interfere with the nervous system of pests and achieve the purpose of efficient insecticide.

In the field of materials science, 3-cyano-4-fluorobenzenesulfonyl chloride also has outstanding performance. It can be used to prepare special polymer materials. By reacting with monomers containing specific functional groups, its unique structure is introduced into the polymer main chain or side chain to change the physical and chemical properties of the polymer. If high-performance engineering plastics are prepared, the heat resistance, mechanical strength and chemical stability of the material can be improved, making the material suitable for harsher working environments.

Furthermore, in the synthesis of dyes, its structure can participate in the construction of the color system of dye molecules. By rationally designing the reaction path, connecting it to dye molecules may be able to regulate the color, light stability and dyeing properties of dyes. For example, synthesizing new reactive dyes can improve the bonding force between dyes and fibers, making the dyeing effect more lasting and bright.

In summary, 3-cyano-4-fluorobenzenesulfonyl chloride plays a key role in many fields such as medicine, pesticides, materials and dyes, and has made significant contributions to promoting technological development and innovation in various fields.

What are the physical properties of 3-Cyano-4-fluorobenzenesulphonyl chloride?

3-Cyano-4-fluorobenzenesulfonyl chloride is an important compound in organic synthesis. Its physical properties are as follows:

Looking at its properties, at room temperature, 3-cyano-4-fluorobenzenesulfonyl chloride is often colorless to slightly yellow liquid, with a clear appearance and a certain fluidity. The color of this compound, due to different preparation processes and impurity content, or slightly different, is generally in the category of colorless to slightly yellow.

When it comes to odor, it emits an irritating odor and is uncomfortable to smell. This irritating odor originates from the presence of active groups in its chemical structure, which has a significant stimulating effect on the olfactory nerve.

As for the boiling point, the boiling point of 3-cyano-4-fluorobenzenesulfonyl chloride is in a specific temperature range. However, the exact boiling point is affected by many factors, such as the ambient pressure, so it is usually determined under standard pressure conditions. Generally speaking, its boiling point is relatively high, which is due to the strong interaction forces between molecules, including van der Waals forces and dipole-dipole interactions caused by polar groups such as cyano and sulfonyl chloride.

In terms of melting point, this compound has a certain melting point. At the melting point temperature, its material state changes from solid to liquid. The exact value of the melting point is also affected by impurities. The melting point of pure 3-cyano-4-fluorobenzenesulfonyl chloride is relatively fixed, but the mixing of impurities can cause the melting point to change, increase or decrease.

Solubility is also one of its important physical properties. 3-cyano-4-fluorobenzenesulfonyl chloride exhibits different solubility in organic solvents. Common organic solvents such as dichloromethane, chloroform, toluene, etc. have good solubility and can form a homogeneous solution with them. This is because the compound can form suitable interactions with these organic solvent molecules, such as van der Waals force, dipole-dipole interaction, etc., thereby promoting the dissolution process. However, in water, its solubility is poor, due to the fact that there are few hydrophilic groups in its molecular structure, and the hydrophobicity of cyano and sulfonyl chloride is relatively strong, making it difficult to form effective interactions with water molecules, so it is difficult to dissolve in water.

In terms of density, 3-cyano-4-fluorobenzenesulfonyl chloride is heavier than water, and it can sink in water. The exact value of its density is also related to temperature. When the temperature changes, the intermolecular spacing changes, which in turn causes the density to fluctuate. Usually under normal temperature conditions, its density remains relatively stable.

In summary, the physical properties of 3-cyano-4-fluorobenzenesulfonyl chloride, such as its properties, odor, boiling point, melting point, solubility, and density, play a key role in organic synthesis and related applications. Accurate understanding of its properties can help to better carry out relevant experiments and production activities.

What is the synthesis method of 3-Cyano-4-fluorobenzenesulphonyl chloride?

The synthesis of 3-cyano-4-fluorobenzenesulfonyl chloride is a key issue in the field of organic synthesis. Its synthesis path is diverse. When the classical chemical synthesis method is used as the basis, the principle and conditions of each step of the reaction are analyzed in detail.

The first step is often to start with a benzene ring compound containing the corresponding substituent. For example, 3-cyano-4-fluorobenzene can be selected as the starting material. Because the cyano group and fluorine atoms on the benzene ring have specific positions, it lays the foundation for the subsequent introduction of sulfonyl chloride.

Then, to introduce a sulfonyl chloride group, a sulfonation reaction is often used. Sulfonation reagents such as fuming sulfuric acid or chlorosulfonic acid can be selected. Taking chlorosulfonic acid as an example, when it reacts with 3-cyano-4-fluorobenzene, the sulfonyl group of chlorosulfonic acid (-SO 2O Cl) can replace the hydrogen atom at a specific position on the benzene ring. This reaction requires careful temperature control, generally between low temperature and room temperature. If the temperature is too high, it may cause frequent side reactions, such as the formation of polysulfonation products, or other reactions caused by the influence of cyano and fluorine atoms. During the

reaction process, the molar ratio of chlorosulfonic acid to the substrate is also a key factor. The appropriate molar ratio is about 1.2 - 1.5:1, which can ensure that the reaction is fully carried out and avoid the cost increase and subsequent separation difficulties caused by excessive chlorosulfonic acid.

After the sulfonation reaction is completed, an intermediate containing a sulfonyl group (-SO < H >) is obtained. At this time, to convert the sulfonyl group into a sulfonyl chloride group (-SO < C > Cl), chlorination reagents such as thionyl chloride (SOCl < L >) can be used. Sulfoxide chloride reacts with a sulfonyl-containing intermediate. After the substitution process, the hydroxyl group of the sulfonyl group is replaced by a chlorine atom to form the target product 3-cyano-4-fluorobenzenesulfonyl chloride. This step also requires attention to conditions, such as adding an appropriate amount of catalysts, such as N, N-dimethylformamide (DMF), which can promote the reaction rate. The reaction temperature can be controlled between 50 and 80 ° C, and the reaction can be refluxed for several hours to ensure the complete reaction.

After the reaction is completed, the product needs to be separated and purified. Vacuum distillation and column chromatography are often used. Vacuum distillation can be separated according to the difference in boiling point between the product and the impurity; column chromatography is further purified according to the distribution coefficient of the product and the impurity in the stationary and mobile phases to obtain high purity 3-cyano-4-fluorobenzenesulfonyl chloride.

What to pay attention to when storing and transporting 3-Cyano-4-fluorobenzenesulphonyl chloride

3-Cyano-4-fluorobenzenesulfonyl chloride is a chemical substance. When storing and transporting it, many matters need to be paid careful attention.

First words storage. This material is more active and should be stored in a cool, dry and well-ventilated place. Cover because it is more sensitive to heat, if it is in a high temperature environment, it may cause changes in chemical properties or even cause dangerous reactions. The temperature of the warehouse should be controlled within a specific range to avoid excessive temperature fluctuations. And it needs to be kept away from fire and heat sources. The proximity of open flames can easily lead to disasters. Because it may be corrosive and irritating, it should be stored separately from oxidants and alkalis, and should not be mixed to prevent interaction and accidents. The storage place should also be equipped with suitable materials to contain leaks in case of emergency.

Times and transportation. Before transportation, make sure that the packaging is intact. The packaging material must be able to resist the erosion of this substance and have a good seal to prevent leakage. During transportation, the speed should not be too fast, avoid violent actions such as sudden braking, to prevent the packaging from being damaged by vibration and collision. Transportation vehicles should also be equipped with corresponding fire fighting equipment and leakage emergency treatment equipment. In case of emergencies, they can respond in time. And transportation personnel need to be professionally trained, familiar with the characteristics of this substance and emergency response methods. Transportation routes should also avoid densely populated areas and environmentally sensitive areas to ensure safety.

What are the effects of 3-Cyano-4-fluorobenzenesulphonyl chloride on the environment and human body?

3-Cyano-4-fluorobenzenesulfonyl chloride is very important in the impact of the environment and the human body.

First of all, its impact on the environment. If it escapes into nature, the first to bear the brunt is the water body. Because of its chemical activity, or water quality changes, it interferes with the survival of aquatic organisms. In rivers, lakes and seas, or disrupts the aquatic ecological balance, causing a sharp decrease in the number of aquatic organisms, such as plankton, fish and shrimp. It may change the pH of the water body, affect the microbial community structure in the water, and then interfere with the self-purification ability of the water body.

Furthermore, if it enters the soil, or changes the chemical properties of the soil, it affects the soil fertility and structure. It may cause poisoning to microorganisms and plant roots in the soil, hinder plant growth, reduce vegetation coverage, and cause chain reactions such as soil erosion. In the atmospheric environment, although it is not easy to evaporate, if its tiny particles accidentally leak into the air during production, transportation or disposal, it may also affect the air quality and endanger the surrounding ecology.

As for the impact on the human body, its contact with the skin can cause skin burns, allergies and other symptoms, causing skin redness, swelling, itching, and pain. If it is not carefully entered into the eyes, it will cause great irritation to the eyes, or cause congestion of the conjunctiva of the eye, vision damage, and blindness in serious cases. Inhalation of its volatile gas or dust can irritate the respiratory tract, cause symptoms such as cough, asthma, breathing difficulties, long-term exposure, or cause lung diseases and damage the health of the respiratory system. If ingested by mistake, it is also seriously harmful to the digestive system, or cause oral, throat, gastrointestinal burns, vomiting, abdominal pain, diarrhea and other symptoms, and even life-threatening.

In short, 3-cyano-4-fluorobenzenesulfonyl chloride poses a latent risk to the environment and the human body. When using and disposing of it, it must be careful to prevent the spread of its harm.