Chemical Formula | C6H2BrF3 |
Molar Mass | 225.98 g/mol |
Appearance | Colorless to light yellow liquid |
Boiling Point | 143 - 144 °C |
Melting Point | N/A |
Density | 1.81 g/cm³ |
Solubility In Water | Insoluble |
Solubility In Organic Solvents | Soluble in common organic solvents |
Flash Point | 49 °C |
Purity | Typically high purity in commercial products |
Chemical Formula | C6H2BrF3 |
Molecular Weight | 225.98 |
Appearance | Colorless to light yellow liquid |
Boiling Point | 148 - 150 °C |
Density | 1.72 g/cm³ |
Solubility | Insoluble in water, soluble in organic solvents |
Flash Point | 48 °C |
Refractive Index | 1.475 - 1.477 |
Chemical Formula | C6H2BrF3 |
Molecular Weight | 225.98 |
Appearance | Colorless to light yellow liquid |
Boiling Point | 146 - 148 °C |
Density | 1.828 g/mL at 25 °C |
Flash Point | 49 °C |
Solubility In Water | Insoluble |
Refractive Index | 1.474 |
What are the main uses of 1-Bromo-2,4,5-trifluorobenzene?
1 - Bromo - 2,4,5 - trifluorobenzene is a crucial raw material in organic synthesis and is widely used in many fields.
In the field of medicinal chemistry, it is a key intermediate for the synthesis of new drugs. Due to the bromine and fluorine atoms in the molecule, compound structures with specific biological activities can be constructed through various chemical reactions. For example, by nucleophilic substitution reactions, bromine atoms can be replaced by groups containing heteroatoms such as nitrogen and oxygen, so as to synthesize drug molecules with high affinity and biological activity for specific disease targets, providing an important structural basis for innovative drug development.
In the field of materials science, it also plays an important role. With its unique electronic structure and reactivity, it can participate in the preparation of functional polymer materials. For example, it is introduced into the polymer chain by polymerization reaction, giving the material special electrical, optical or thermal properties. Fluorine-containing groups can improve the chemical stability and weather resistance of the material, while bromine atoms can be used as reaction check points to further modify the material structure and prepare advanced materials such as organic optoelectronic materials and high-performance engineering plastics.
In the field of pesticide chemistry, 1 - Bromo - 2,4,5 - trifluorobenzene is also an important starting material for the synthesis of high-efficiency pesticides. By modifying its structure, pesticides with high pest toxicity and environmental friendliness can be obtained. The introduction of fluorine atoms can enhance the interaction between pesticide molecules and target proteins in pests, improve drug efficacy, and bromine atoms can participate in subsequent reactions to optimize the physicochemical properties of pesticide molecules, such as solubility, volatility, etc., making them more suitable for field application.
In summary, 1-Bromo-2,4,5-trifluorobenzene plays an indispensable role in many fields such as medicine, materials and pesticides due to its unique chemical structure and reactivity, and is of great significance to promote technological progress and industrial development in related fields.
What are the physical properties of 1-Bromo-2,4,5-trifluorobenzene?
1-Bromo-2,4,5-trifluorobenzene is also an organic compound. It has unique physical properties and is related to many chemical applications.
Looking at its appearance, under normal temperature and pressure, 1-bromo-2,4,5-trifluorobenzene is often a colorless to light yellow transparent liquid, clear and free of variegation, with clear visual characteristics. This is the main point of preliminary identification in chemical experiments and industrial production.
The boiling point is about 145-147 ° C. The boiling point is the critical temperature at which a substance changes from liquid to gas. This boiling point value reflects the strength of the intermolecular forces of the compound. When heated to this temperature range, the molecules gain enough energy to break free from each other's attractive forces and escape from the liquid surface to form a gaseous state. This property is crucial in the separation and purification process. By distillation, pure 1-bromo-2,4,5-trifluorobenzene can be extracted from the mixture according to the difference in boiling point.
Its density is about 1.825 g/mL (25 ° C). Density, the mass of a substance per unit volume. This value shows that under the same volume, 1-bromo-2,4,5-trifluorobenzene is heavier than water. In liquid-liquid separation operations, if it is mixed with liquids of different densities such as water, it will be layered according to density to facilitate separation.
Furthermore, the solubility of 1-bromo-2,4,5-trifluorobenzene is also characterized. It is insoluble in water, but soluble in common organic solvents such as ether, dichloromethane, acetone, etc. This difference in solubility is due to molecular structure and polarity. Water molecules have strong polarity, while 1-bromo-2,4,5-trifluorobenzene molecules have weaker polarity. According to the principle of "similar miscibility", it is difficult to dissolve in water and easily soluble in organic solvents with similar polarity. This property can be used in organic synthesis to select suitable reaction solvents, promote the reaction, and facilitate the separation and purification of products.
What are the chemical properties of 1-Bromo-2,4,5-trifluorobenzene?
1 - Bromo - 2,4,5 - trifluorobenzene is an organic compound with interesting chemical properties and many special features.
In this compound, the bromine atom is connected to the benzene ring with three fluorine atoms. The fluorine atom has strong electronegativity, which has a significant impact on the electron cloud density distribution of the benzene ring. Due to the electron-withdrawing effect of fluorine atoms, the electron cloud density of the benzene ring decreases, especially at the adjacent and para-sites. This makes the electrophilic substitution of the benzene ring less active, and it is more difficult to occur electrophilic substitution reactions such as halogenation, nitrification, and sulfonation than benzene itself.
As for the bromine atom, it can participate in nucleophilic substitution reactions under appropriate conditions. If there is a nucleophilic reagent, the nucleophilic reagent will attack the carbon atoms connected to the bromine, and the bromine ions will leave to form new compounds. For example, by reacting with sodium alcohol, corresponding ethers can be formed; by reacting with ammonia or amines, nitrogen-containing derivatives can be obtained.
In addition, due to the presence of multiple halogen atoms in the molecule, it can participate in coupling reactions under metal catalysis. For example, Suzuki coupling reactions with boron-containing reagents under palladium catalysis can form carbon-carbon bonds and generate more complex aromatic compounds, which are widely used in the field of organic synthesis and can be used to prepare various organic compounds such as drugs and materials. Due to the presence of multiple halogen atoms, at high temperatures or under specific conditions, elimination reactions may occur to remove hydrogen halide and generate compounds containing unsaturated bonds, which in turn participate in more types of subsequent reactions, providing a variety of paths for organic synthesis.
What are the synthesis methods of 1-Bromo-2,4,5-trifluorobenzene?
There are several common methods for the synthesis of 1-bromo-2,4,5-trifluorobenzene.
First, trifluorobenzene is used as the starting material and obtained by bromination reaction. This reaction usually requires the selection of suitable brominating reagents, such as bromine ($Br_2 $), and the assistance of suitable catalysts. Under the action of the catalyst, bromine and trifluorobenzene undergo electrophilic substitution. Commonly used catalysts, such as iron powder ($Fe $) or iron tribromide ($FeBr_3 $). During the reaction, the hydrogen atom in the trifluorobenzene molecule is replaced by a bromine atom to form 1-bromo-2,4,5-trifluorobenzene. In this process, it is necessary to pay attention to the control of the reaction temperature and reaction time. If the temperature is too high, it may cause the formation of polybrominated by-products; if the time is too short, the reaction will be incomplete.
Second, it can be started from halogenated aromatics containing fluorine and achieved by halogen exchange reaction. Select an appropriate halogenated aromatic hydrocarbon containing fluorine and react with brominating reagents under specific conditions. For example, using chlorine-containing fluorobenzene as a substrate, react with bromine sources such as potassium bromide ($KBr $) in a suitable solvent in the presence of a phase transfer catalyst. Phase transfer catalysts can facilitate the reaction by crossing the two-phase interface with coionic reagents. Commonly used phase transfer catalysts include quaternary ammonium salts such as tetrabutylammonium bromide ($TBAB $). In the reaction, the chlorine atom is replaced by the bromine atom to obtain 1-bromo-2,4,5-trifluorobenzene. This method requires more stringent reaction conditions, and the choice of solvent, reaction temperature and time have a significant impact on the yield and purity of the product.
Furthermore, benzene is used as the initial raw material to construct the target product through a multi-step reaction. First, the benzene is fluorinated to introduce fluorine atoms to obtain fluorobenzene derivatives. The fluorophilic reaction can use electrophilic fluorinated reagents, such as Selectfluor. Subsequently, the obtained fluorobenzene derivatives are brominated, and bromine atoms are introduced as described above, and finally 1-bromo-2,4,5-trifluorobenzene is synthesized. Although there are many steps in this route, the raw material benzene is widely sourced and the cost is relatively low. However, the problem caused by the multi-step reaction is that the total yield is easily affected, and the separation and purification operation after each step is also complicated.
The above synthesis methods have their own advantages and disadvantages. In practical application, it is necessary to comprehensively consider many factors such as raw material cost, reaction conditions, product yield and purity, and choose the most suitable method.
What are the precautions for storing and transporting 1-Bromo-2,4,5-trifluorobenzene?
1 - Bromo - 2,4,5 - trifluorobenzene is an organic compound. During storage and transportation, the following precautions should be followed:
** Storage essentials **:
First, a cool and ventilated warehouse must be placed. Because the compound is heated, it is easy to cause chemical reactions, or even cause safety risks. If the warehouse temperature is too high, or the molecular activity is enhanced, it increases the possibility of decomposition, polymerization and other reactions.
Second, keep away from fire and heat sources. This compound has a certain chemical activity. In case of open flame, hot topic, or cause combustion or explosion. If common organic halides are exposed to high temperature open flame, they are prone to violent reactions.
Third, it should be stored separately from oxidants and alkalis, and should not be mixed. 1 - Bromo - 2,4,5 - trifluorobenzene encounters oxidants or reacts with oxidation; in case of alkalis, or reactions such as substitution and elimination, it can cause material deterioration and may be dangerous.
Fourth, the warehouse must prepare suitable materials for containing leaks. If there is a leak, it can be collected in time to prevent its spread from causing environmental pollution and safety problems.
** Regulations of transportation **:
First, the packaging should be complete and sealed before transportation. If the packaging is damaged, the compound leaks, or the surrounding personnel are exposed to poisoning, it will also pollute the environment. If it is bumpy and collided during transportation, if the packaging is not solid, it is easy to be damaged and leak.
Second, when transporting, it should be strictly implemented in accordance with the rules for the transportation of dangerous goods. Because of its certain danger, the transportation vehicle must have corresponding warning signs, and the transportation personnel should also undergo professional training and be familiar with emergency treatment methods.
Third, during transportation, protect against exposure to the sun, rain, and high temperature. Sunlight exposure and rain, or react with compounds such as hydrolysis; high temperature environment also increases its reactivity, causing potential safety hazards.
Fourth, it is strictly forbidden to mix with oxidants, alkalis, etc. In the case of mixed transportation, different substances interact with each other, or produce uncontrollable chemical reactions, which threaten transportation safety.