Chemical Formula | C7H4BrF3O |
Molecular Weight | 241.004 |
Chemical Formula | C7H4BrF3O |
Molecular Weight | 239.004 g/mol |
Appearance | liquid (usually) |
Boiling Point | data may vary, around 180 - 200 °C (estimated based on similar compounds) |
Density | data may vary, but expected to be around 1.6 - 1.8 g/cm³ (estimated) |
Solubility In Water | low solubility, as it is an organic fluorinated compound |
Solubility In Organic Solvents | soluble in common organic solvents like dichloromethane, chloroform |
Vapor Pressure | low vapor pressure at room temperature |
Chemical Formula | C7H4BrF3O |
Molecular Weight | 239.005 |
Appearance | Colorless to light yellow liquid (predicted) |
Boiling Point | Approx. 183 - 185 °C (estimated) |
Density | Estimated around 1.7 - 1.8 g/cm³ |
Solubility In Water | Low, likely insoluble due to non - polar benzene ring and fluorine - containing groups |
Solubility In Organic Solvents | Soluble in common organic solvents like dichloromethane, toluene |
Vapor Pressure | Low at room temperature |
Flash Point | Estimated around 70 - 80 °C (flammability hazard) |
What is the main use of 4-Bromo-2- (difluoromethoxy) -1-fluorobenzene?
4-Bromo-2- (difluoromethoxy) -1-fluorobenzene, an organic compound, is widely used in the field of organic synthesis.
First, it is often used to create new pesticides. Because its molecular structure contains atoms such as fluorine and bromine, it endows the compound with unique physical and chemical properties and biological activities. The introduction of fluorine atoms can significantly improve the lipid solubility of the compound, making it easier to penetrate biofilms and enhance the effect on pest targets; the presence of bromine atoms also has a positive impact on biological activity. Therefore, using 4-bromo-2- (difluoromethoxy) -1-fluorobenzene as raw materials, pesticides with high insecticidal and bactericidal properties can be synthesized, which can help agricultural pest control and improve crop yield and quality.
Second, in the field of pharmaceutical research and development, this compound also plays an important role. Its unique structure can be used as a key intermediate to construct drug molecules with specific pharmacological activities. By modifying and modifying its structure, drugs that act on different targets, such as anti-tumor and antiviral drugs, can be obtained. According to the principle of drug design, scientists can introduce different functional groups on the basis of this compound to adjust its interaction with biomacromolecules, so as to develop innovative drugs with better curative effect and less side effects.
Third, in the field of materials science, 4-bromo-2- (difluoromethoxy) -1-fluorobenzene can be used to prepare special polymer materials. Due to its structural characteristics, after participating in the polymerization reaction, it can endow polymer materials with excellent properties such as weather resistance and chemical corrosion resistance. These special polymer materials can be used in high-end fields such as aerospace, electronics and electrical appliances to meet the strict requirements for the special properties of materials in related fields.
In summary, 4-bromo-2- (difluoromethoxy) -1-fluorobenzene, with its unique structure, has important application value in many fields such as pesticides, medicine, materials, etc. It is of great significance to promote the development of related fields.
What are the physical properties of 4-Bromo-2- (difluoromethoxy) -1-fluorobenzene
4-Bromo-2- (difluoromethoxy) -1-fluorobenzene, an organic compound. Its physical properties are detailed below.
Looking at its physical state, under normal temperature and pressure, it is often colorless to pale yellow liquid, with a clear texture and no visible impurities. The existence of this state is due to the characteristics of intermolecular forces and structures. The presence of halogen atoms and methoxy groups in the molecule affects the interaction between molecules, resulting in its liquid state in the common temperature range.
Smell it, it has a weak but special smell, but it is not pungent and unpleasant to smell, but its specific smell can be felt. This odor originates from the chemical structure of the molecule. The combination of halogenated aromatics and methoxy groups generates unique volatile molecules that stimulate olfactory receptors.
As for the boiling point, it is about a specific temperature range. Because the molecule contains halogen atoms such as bromine and fluorine and difluoromethoxy groups, the intermolecular forces are complex, resulting in a high boiling point. Specifically, its boiling point reflects the energy required for the molecule to break free from the liquid phase, which is related to molecular polarity and molecular weight. Halogen atoms increase molecular polarity and enhance intermolecular forces, so the boiling point is higher than that of simple aromatics.
Melting point is also an important physical property. Its melting point determines the transition temperature between solid and liquid states. The regularity of molecular structure and intermolecular forces affect the melting point. The molecule of this compound is not highly symmetric due to the distribution of substituents, resulting in a non-tight and orderly arrangement between molecules, and a relatively low melting point.
In terms of density, it is heavier than water, placed in water, and sinks at the bottom. This is because the molecule contains heavy atoms bromine and fluorine, which increase the weight per unit volume. Its density is an essential property of the substance, which is related to the molecular composition and accumulation mode.
In terms of solubility, it is slightly soluble in water. Water is a polar solvent, and although the compound contains polar groups, it still has strong hydrophobicity as a whole. The aromatic hydrocarbon part and halogenated structure in the molecule make it weak in forming hydrogen bonds with water molecules, so it is difficult to dissolve in water. However, in organic solvents, such as ethanol, ether, dichloromethane, etc., it has good solubility. The organic solvent and the compound have similar polarity or intermolecular force, and can miscible with each other.
This is the general physical properties of 4-bromo-2- (difluoromethoxy) -1-fluorobenzene, which is the basis for its chemical application and research.
What are the synthesis methods of 4-Bromo-2- (difluoromethoxy) -1-fluorobenzene
The synthesis methods of 4-bromo-2- (difluoromethoxy) -1-fluorobenzene generally include the following.
First, fluorophenols are used as starting materials. First, fluorophenols are halogenated to introduce bromine atoms. For example, in a suitable solvent, in the presence of a specific catalyst, react with brominating reagents such as bromine or hydrobromic acid to introduce bromine atoms at the ortho or para-site of phenolic hydroxyl groups. Then, difluoromethoxy is introduced through etherification reaction. Difluoromethylating reagents, such as difluoromethane, can be used to react with halogenated phenols under the action of bases to form the target product. This process requires precise control of the reaction conditions. Temperature, amount and type of base will all affect the reaction process and product yield.
Second, start from halobenzene. First, the halobenzene is selectively fluorinated. Nucleophilic fluorination can be used to select a suitable fluorine source, such as potassium fluoride, etc. Under the action of a phase transfer catalyst, the halogen atom is partially replaced with a fluorine atom. Next, a methoxylation reaction is carried out, and a difluoromethoxy group is introduced. Difluoromethyl halides can be used to react with halogenated fluorobenzene under basic conditions to form the target compound. In this path, the selectivity of the fluorination reaction and the efficiency of the methoxylation reaction are both key.
Third, the coupling reaction catalyzed by transition metals. Using halogenated aromatics as substrates and catalyzed by transition metal catalysts such as palladium and copper, the coupling reaction with fluorine-containing alkenyl or alkyl halides occurs, and fluorine atoms and difluoromethoxy groups are introduced at the same time. The reaction conditions of this method are relatively mild, but the catalyst is expensive and the reaction cost is high. Moreover, the loading amount of the catalyst and the choice of ligand have a great influence on the reaction, and the reaction parameters need to be carefully optimized to improve the yield and purity of the product.
What are the precautions for 4-Bromo-2- (difluoromethoxy) -1-fluorobenzene during storage and transportation?
4-Bromo-2- (difluoromethoxy) -1-fluorobenzene is also an organic compound. During storage and transportation, many matters must be paid attention to.
When storing, the first environment. This compound should be placed in a cool, dry and well-ventilated place. Because the shade can avoid the risk caused by high temperature, the drying can avoid the interaction with water vapor, and the good ventilation can quickly disperse the harmful gases that may accumulate. High temperature can easily cause its volatilization to intensify, or cause chemical reactions to cause the deterioration of the compound; water vapor or react with it, affecting its purity and properties.
Furthermore, it must be prevented from contacting with incompatible substances. Such as strong oxidizing agents, strong alkalis, etc., may react violently with 4-bromo-2- (difluoromethoxy) -1-fluorobenzene, or cause the risk of combustion or explosion. Therefore, when storing, it must be placed separately from such substances, and clearly marked to indicate contraindications.
Packaging is also key. The packaging materials used must have good sealing to prevent the intrusion of air, water vapor, etc. And the packaging should be sturdy and durable, able to withstand certain external forces, so as to avoid compound leakage caused by package damage during transportation.
During transportation, drivers and escorts should be familiar with the properties and emergency treatment methods of 4-bromo-2- (difluoromethoxy) -1-fluorobenzene. Transportation vehicles must be equipped with corresponding fire equipment and leakage emergency treatment equipment. During driving, avoid high temperature periods and bumpy road sections, drive slowly and steadily to prevent packaging damage due to vibration and collision.
If a leak unfortunately occurs, the first thing to do is to evacuate the surrounding personnel and set up a warning area. Emergency responders must wear professional protective equipment. According to the leakage situation, or absorb it with inert materials such as sand and vermiculite, or collect it in a suitable container, and then properly dispose of it. Do not dump it at will to avoid polluting the environment.
What is the environmental impact of 4-Bromo-2- (difluoromethoxy) -1-fluorobenzene?
4-Bromo-2- (difluoromethoxy) -1-fluorobenzene is an organic compound, which is widely used in industry and scientific research, but its impact on the environment is worthy of investigation.
First of all, its chemical properties, this compound contains bromine, fluorine and other halogen elements, and difluoromethoxy. Halogen elements make the compound have certain stability and reactivity, but also affect its behavior in the environment. Its chemical structure may be difficult to degrade in the environment, and there is a risk of long-term residue.
In the ecosystem, if the substance enters the water body, or is adsorbed on suspended particles due to hydrophobicity, it will settle to the bottom sediment, causing benthic organisms to be exposed to it. Its halogen atoms may interfere with normal biochemical reactions in organisms, such as halogenation reactions or affect enzyme activities and biomolecular synthesis. And this compound may be bioaccumulative in the food chain. After ingestion by small organisms, it is transmitted through the food chain, causing the concentration of high trophic level organisms to gradually rise, endangering biological health.
In the atmospheric environment, although volatile or limited, it is volatilized or transported by the atmosphere, or it is distributed in a wider area. Under light, photochemical reactions may occur, generating new harmful substances and affecting air quality.
In the soil environment, due to chemical structure stability or long-term retention, it affects the structure and function of soil microbial communities, hinders normal material circulation and energy conversion in the soil, and affects plant growth and development.
In conclusion, 4-bromo-2 - (difluoromethoxy) -1-fluorobenzene has many potential hazards to the environment. It is essential to study its environmental behavior and fate, and take appropriate prevention and control measures for environmental protection.