Chemical Formula | C6H2BrClF2O2S |
Molecular Weight | 309.497 |
Appearance | Solid (likely white to off - white powder or crystals) |
Solubility In Water | Low, as it contains non - polar benzene ring and hydrophobic groups |
Solubility In Organic Solvents | Soluble in common organic solvents like dichloromethane, chloroform |
Vapor Pressure | Low at room temperature due to its solid state and relatively large molecular mass |
Reactivity | Highly reactive, with the sulfonyl chloride group being prone to hydrolysis and nucleophilic substitution reactions |
Name | 4-bromo-2,5-difluorobenzenesulfonyl chloride |
Molecular Formula | C6H2BrClF2O2S |
Molecular Weight | 307.497 |
Appearance | Typically a solid (physical state can vary based on conditions) |
Solubility | Likely sparingly soluble in water due to non - polar benzene ring and polar sulfonyl chloride group, solubility in organic solvents varies |
Purity | Can be produced in various purity levels depending on synthesis and purification methods |
Reactivity | Reactive due to the presence of sulfonyl chloride group, can react with nucleophiles |
Name | 4-bromo-2,5-difluorobenzenesulfonyl chloride |
Molecular Formula | C6H2BrClF2O2S |
Molecular Weight | 307.5 |
Appearance | Typically a solid (physical state can depend on conditions) |
Melting Point | Data may vary, needs experimental determination |
Boiling Point | Data may vary, needs experimental determination |
Density | Data may vary, needs experimental determination |
Solubility | Solubility characteristics depend on solvents, e.g., likely soluble in some organic solvents |
Purity | Can vary depending on production and purification methods |
Chemical Reactivity | Reactive due to sulfonyl chloride group, can react with nucleophiles |
Storage Conditions | Should be stored in a cool, dry place away from moisture and heat |
What are the physical properties of 4-bromo-2, 5-difluorobenzenesulfonyl chloride?
4-Bromo-2,5-difluorobenzenesulfonyl chloride is an important compound in organic chemistry. Its physical properties are quite characteristic, let me tell them one by one.
Looking at its appearance, under room temperature and pressure, this substance is often colorless to light yellow liquid, with a clear texture, like clear spring water. However, it is not to be desecrated, because it has a certain degree of irritation, and it needs to be carefully protected during operation.
There is no exact ancient book on the melting point, but it is speculated from today's chemical research that it should be in a relatively low temperature range. The number of boiling points is about a certain range, and this value is determined by many factors such as intermolecular forces and relative molecular masses. Because its molecular structure contains bromine, fluorine, chlorine and other halogen atoms, the intermolecular force is enhanced, and the boiling point is also increased.
The density of this compound is heavier than that of water. If it is placed in water, it will sink to the bottom. And its solubility is also unique. In organic solvents, such as ether and dichloromethane, it can be dissolved quite well, just like fish swimming freely in water; in water, the solubility is very small, just like the incompatibility of oil and water.
The vapor pressure of 4-bromo-2,5-difluorobenzenesulfonyl chloride is low, indicating that its volatilization rate is slow at room temperature. However, it should not be taken lightly, because steam still has certain dangers. Its odor is pungent and unpleasant, because it contains halogen atoms and sulfonyl chloride groups.
From the above, the physical properties of 4-bromo-2,5-difluorobenzenesulfonyl chloride are closely related to its molecular structure. Understanding these properties has important guiding significance in many fields such as organic synthesis and chemical analysis.
What are the chemical properties of 4-bromo-2, 5-difluorobenzenesulfonyl chloride
4-Bromo-2,5-difluorobenzenesulfonyl chloride is a crucial compound in the field of organic synthesis. It has active chemical properties and shows unique properties in many chemical reactions.
In this compound, the chlorine atom is connected to the sulfonyl group and has good activity. In nucleophilic substitution reactions, chlorine atoms are easily replaced by various nucleophilic reagents. For example, when it encounters alcohols, chlorine can be replaced by alkoxy groups to generate corresponding sulfonates. This reaction is often used to prepare organosulfonate compounds with specific functions, and is widely used in materials science and pharmaceutical chemistry.
Bromine atoms are also active and can participate in many reactions under specific conditions. For example, in a metal-catalyzed coupling reaction, it can react with carbon-containing nucleophiles to form carbon-carbon bonds, thereby extending the carbon chain structure of the benzene ring and laying the foundation for the synthesis of more complex organic molecules.
The existence of two fluorine atoms greatly affects the electron cloud distribution and spatial structure of the molecule. Fluorine atoms have strong electronegativity, which can reduce the electron cloud density of the benzene ring, which in turn affects the reactivity of other substituents on the benzene ring. At the same time, the introduction of fluorine atoms can change the physical properties of molecules, such as improving the lipid solubility of compounds, which is of great significance in drug development. Because the appropriate lipid solubility helps the drug to pass through the biofilm and improve the bioavailability.
Under alkaline conditions, 4-bromo-2,5-difluorobenzenesulfonyl chloride can undergo hydrolysis, and the sulfonyl chloride group is hydrolyzed into a sulfonic acid group to form corresponding sulfonic acid compounds. This reaction is often used in the preparation of sulfonic acid surfactants or other functional materials containing sulfonic acid groups in fine chemical production.
In conclusion, 4-bromo-2,5-difluorobenzenesulfonyl chloride plays a key role in many fields such as organic synthesis, pharmaceutical chemistry, and materials science due to its unique chemical properties. It provides an important starting material and reaction intermediate for the creation of novel compounds with specific functions.
What are the main uses of 4-bromo-2, 5-difluorobenzenesulfonyl chloride?
4-Bromo-2,5-difluorobenzenesulfonyl chloride is a key raw material for organic synthesis and has a wide range of uses in the fields of medicine, pesticides and materials science.
In the field of medicine, this compound is an important intermediate for the synthesis of new drugs. The bromine, fluorine and sulfonyl chloride functional groups in its structure give unique reactivity and biological activity. With the special electronic effects and spatial effects of bromine and fluorine atoms, the lipid solubility, stability and binding ability of drug molecules can be optimized. For example, when developing antiviral and anticancer drugs, use them as the starting material to build the core structure, and modify it through subsequent reactions. It is expected to obtain high-efficiency and low-toxicity innovative drugs.
In the field of pesticides, 4-bromo-2,5-difluorobenzenesulfonyl chloride is also indispensable. By introducing specific functional groups, pesticides with high insecticidal, bactericidal and herbicidal activities can be designed and synthesized. Fluorine atoms can enhance the binding affinity of pesticide molecules with targets in vivo and improve drug efficacy; bromine atoms help to improve the environmental stability and biological activity of pesticides. It can develop new pesticides with environmental friendliness, high selectivity and excellent activity, providing strong support for agricultural pest control.
In the field of materials science, it can be used to prepare functional polymer materials. Sulfonyl chloride functional groups can react with polymers containing hydroxyl groups and amino groups to introduce bromine and fluorine substituted benzene ring structures, thereby changing the properties of polymer materials. For example, when preparing high-performance engineering plastics, the addition of this compound can enhance the material's heat resistance, chemical corrosion resistance, and mechanical properties, broadening the material's application range, and playing an important role in high-end fields such as aerospace, electronics, and appliances.
What is the synthesis method of 4-bromo-2, 5-difluorobenzenesulfonyl chloride?
The synthesis of 4-bromo-2,5-difluorobenzenesulfonyl chloride is an important topic in the field of organic synthesis. The synthesis idea usually begins with the benzene ring structure containing a specific substituent, and the target molecule is gradually constructed through a series of chemical reactions.
Usually, a suitable benzene derivative is taken first, and this derivative needs to contain functional groups that can be converted into bromine, fluorine and sulfonyl chloride groups by reaction. The initial step may be a halogenation reaction, introducing bromine atoms at specific positions in the benzene ring. In this process, suitable brominating reagents, such as N-bromosuccinimide (NBS), can be selected to realize the bromination reaction of the benzene ring under the action of light or initiator, accurately locate to the target position, and obtain bromine-containing benzene derivatives.
Then, the fluorination reaction is carried out. Nucleophilic fluorinating reagents, such as potassium fluoride, can be used to introduce fluorine atoms into the benzene ring under appropriate solvents and reaction conditions. This step requires careful control of reaction conditions, such as temperature, reaction time, and the proportion of reactants, to ensure that fluorine atoms are precisely replaced at the 2,5-position to obtain 4-bromo-2,5-difluorobenzene derivatives.
The final key step is to convert a group on the benzene ring into a sulfonyl chloride group. Generally, chlorosulfonic acid (ClSO < H) or sulfur trioxide-dichlorosulfoxide (SO < -SOCl <) system can be used to sulfonate the benzene ring and chlorinate it, and finally form 4-bromo-2,5-difluorobenzenesulfonyl chloride. This reaction also requires precise regulation of conditions to ensure complete reaction and minimal side reactions.
During the synthesis process, each step needs to be separated and purified after the reaction, such as column chromatography, recrystallization, etc., to obtain high-purity intermediates and final products to ensure the effectiveness of the synthesis route and product quality.
What are the precautions for 4-bromo-2, 5-difluorobenzenesulfonyl chloride in storage and transportation?
4-Bromo-2,5-difluorobenzenesulfonyl chloride is a chemical substance. When storing and transporting, many key matters need to be paid attention to.
Bear the brunt. When storing, be sure to keep it in a cool, dry and well-ventilated place. This substance is prone to hydrolysis and deterioration in humid air, so the ambient humidity should be strictly controlled, and the relative humidity should be maintained at a low level. The warehouse temperature should also not be too high. Generally, it should be controlled below 25 ° C to prevent high temperature from triggering increased reactivity, resulting in the growth of safety hazards.
Furthermore, because of its corrosive and irritating properties, the storage container must be made of corrosion-resistant materials, such as special glass, polytetrafluoroethylene, etc. The container should be tightly sealed to prevent leakage. When storing, it should be separated from oxidants, alkalis and other substances to avoid chemical reactions.
During transportation, the packaging must be stable and reliable to ensure that it can withstand certain external shocks and bumps. Transportation vehicles should be equipped with good ventilation equipment to prevent the accumulation of volatile gases in the transportation space. Transportation personnel need to be familiar with the characteristics of this chemical substance and emergency treatment methods. During transportation, they should always pay attention to whether the packaging is in good condition and whether there are any signs of leakage.
In addition, whether it is storage or transportation, they must strictly follow relevant regulations and standards, and do a good job of marking and recording for tracking and management. In the event of a leak, effective measures should be taken immediately to evacuate the surrounding personnel, take good protection, and properly handle the leak. Do not slack off. Only in this way can the safety of 4-bromo-2,5-difluorobenzenesulfonyl chloride be ensured during storage and transportation.