1 Bromo 4 Chloro 2 Fluorobenzene
Fluorine Difluoride Fluorobenzene Fluorobenzyl Trifluorotoluene
1-Bromo-4-chloro-2-fluorobenzene
Name 1-Bromo-4-chloro-2-fluorobenzene
Molecular Formula C6H3BrClF
Molecular Weight 210.44
Appearance Colorless to light yellow liquid
Boiling Point 196 - 198 °C
Melting Point N/A
Density 1.724 g/cm³
Flash Point 79.4 °C
Solubility In Water Insoluble
Vapor Pressure N/A
Logp 3.65
Refractive Index 1.552
Chemical Formula C6H3BrClF
Molecular Weight 209.44
Appearance Colorless to light yellow liquid
Boiling Point Around 190 - 192 °C
Density Approx. 1.7 g/cm³
Solubility In Water Insoluble
Solubility In Organic Solvents Soluble in common organic solvents like ethanol, ether
Flash Point Around 73 °C
Vapor Pressure Low vapor pressure at room temperature
Odor Characteristic halogen - containing aromatic odor
Name 1-Bromo-4-chloro-2-fluorobenzene
Molecular Formula C6H3BrClF
Molecular Weight 211.44
Appearance Colorless to light yellow liquid
Cas Number 657-07-8
Boiling Point 187 - 188 °C
Density 1.719 g/mL at 25 °C
Flash Point 72 °C
Solubility In Water Insoluble
Vapor Pressure 0.32 mmHg at 25 °C
Refractive Index 1.5565
FAQ

What is the chemistry of 1-Bromo-4-chloro-2-fluorobenzene?

1-Bromo-4-chloro-2-fluorobenzene is also an organic compound. In its molecular structure, the atoms of bromine, chlorine and fluorine on the benzene ring are one place each, resulting in their unique chemical properties.

The reactivity of this compound is very different from that of benzene. The capped halogen atom has an electron-absorbing effect, which decreases the electron cloud density of the benzene ring, and the activity of the electrophilic substitution reaction also decreases. However, different halogen atoms have different effects on the electron cloud density of the benzene ring due to their electronegativity and atomic radius.

In the electrophilic substitution reaction, bromine, chlorine and fluorine atoms are all ortho-para-localizers. However, although fluorine atoms have high electronegativity, due to the small atomic radius, the p-π conjugation effect formed by benzene ring is stronger, resulting in relatively high electron cloud density of its ortho-site, and electrophilic reagents are more likely to attack the ortho-site; while bromine and chlorine atoms, due to the large atomic radius, the conjugation effect is slightly weaker, the density of the meso-site electron cloud is relatively lower, and the tendency of electrophilic substitution reactions to occur in the ortho-para-site is more obvious.

In addition, the halogen atoms of 1-bromo-4-chloro-2-fluorobenzene can participate in a variety of nucleophilic substitution reactions. For example, under suitable conditions, bromine atoms or chlorine atoms can be replaced by nucleophilic reagents to In this process, the halogen atoms leave, and the nucleophilic reagents attack the carbon atoms on the benzene ring, forming a carbon-nucleophilic bond.

Its chemical properties are also significantly affected by the reaction conditions. Temperature, solvent, catalyst and other factors can all affect the rate of the reaction and the selectivity of the product. For example, high temperature or the presence of a specific catalyst may accelerate the reaction process, or even change the reaction pathway and product. In short, the chemical properties of 1-bromo-4-chloro-2-fluorobenzene are complex and interesting, and have important research value and application potential in many fields such as organic synthesis.

What are the main uses of 1-Bromo-4-chloro-2-fluorobenzene?

1-Bromo-4-chloro-2-fluorobenzene is an important member of organic compounds. Its main uses are quite extensive.

In the field of medicinal chemistry, 1-bromo-4-chloro-2-fluorobenzene is often a key intermediate. The development of medicine requires the synthesis of various complex organic molecules. Due to its unique chemical structure, this compound can be cleverly connected with other molecules through many chemical reactions, such as nucleophilic substitution and coupling reactions, to construct compounds with specific biological activities. For example, in the synthesis of some antibacterial and antiviral drugs, 1-bromo-4-chloro-2-fluorobenzene can be used as a starting material. After multiple steps, the desired active ingredient can be obtained.

In the field of materials science, it also has extraordinary uses. In the preparation of organic optoelectronic materials, 1-bromo-4-chloro-2-fluorobenzene can participate in the synthesis of materials with special optoelectronic properties. Due to the presence of halogen atoms, the electron cloud distribution of molecules can be adjusted, which in turn affects the conductivity and luminescence of materials. The materials synthesized from this can be applied to organic Light Emitting Diodes (OLEDs), solar cells and other fields to improve the performance and efficiency of such devices.

In addition, 1-bromo-4-chloro-2-fluorobenzene also plays an important role in pesticide chemistry. The creation of pesticides aims to effectively kill pests and pathogens and ensure the growth of crops. This compound can be used as an important cornerstone for the synthesis of new pesticides. Through rational molecular design and chemical reaction, pesticides can be given better biological activity, selectivity and environmental friendliness. Pesticides synthesized through their participation may be able to precisely act on target organisms, reducing the impact on non-target organisms and reducing residues in the environment, meeting the current needs of green agriculture development.

What are 1-Bromo-4-chloro-2-fluorobenzene synthesis methods?

There are several methods for synthesizing 1-bromo-4-chloro-2-fluorobenzene as follows.

First, it is based on a halogenation reaction. You can first take an appropriate aromatic compound, such as a derivative of benzene. Brominate it, choose a suitable brominating reagent, such as liquid bromine, and add a suitable catalyst, such as iron or iron tribromide. This bromination reaction can introduce bromine atoms at specific positions in the benzene ring. Then, chlorination is carried out. Chlorine gas is used as the chlorination reagent, and a specific catalyst is also required to connect the chlorine atoms to the target location. Finally, through the fluorination reaction, a suitable fluorination reagent, such as potassium fluoride, is used to replace the group in the corresponding position with a fluorine atom under appropriate conditions to obtain 1-bromo-4-chloro-2-fluorobenzene.

Second, it can be achieved through a substitution reaction. First prepare a benzene ring compound containing a specific substituent, whose substituent has the activity that can be replaced by a halogen atom. Take a compound containing a suitable leaving group as a starting material, such as a sulfonate group or a halogen atom (non-target halogen atom). First react with a brominating reagent, so that a bromine atom replaces the leaving group at a specific position. Then, through similar steps, a chlorine atom and a fluorine atom are introduced respectively. In each step of the reaction, it is necessary to precisely adjust the reaction conditions, such as temperature, solvent, reactant ratio, etc., to ensure the selectivity and yield of the reaction.

Third, the method of using metal-organic chemistry can also be considered. Use metal-organic compounds containing benzene rings as raw materials, such as phenyl lithium or phenyl Grignard reagents. First, it reacts with bromine-containing reagents to introduce bromine atoms. After that, it reacts with chlorine-containing and fluorine-containing reagents in sequence, and uses the unique reactivity of metal-organic compounds to achieve the precise integration of each halogen atom in a specific position of the benzene ring. However, this method requires strict reaction environments and needs to be operated under anhydrous and anaerobic conditions to ensure the stability and reactivity of metal-organic compounds.

1-Bromo-4-chloro-2-fluorobenzene need to pay attention to when storing and transporting

1-Bromo-4-chloro-2-fluorobenzene is an organic compound, and many matters must be paid attention to during storage and transportation.

Bear the brunt, and store it in a cool and well-ventilated place. This compound is sensitive to heat, and high temperature can easily cause it to decompose, or even cause dangerous reactions. Therefore, the warehouse temperature should be controlled within a specific range, away from fire and heat sources to prevent accidents.

Furthermore, the sealing of the storage container must be ensured. 1-Bromo-4-chloro-2-fluorobenzene is volatile. If the container is not well sealed, the volatile gas may not only cause material loss, but also accumulate in the air, or cause environmental pollution. What's more, there may be a risk of explosion.

Because of its certain toxicity, the storage place should be strictly managed and prohibited from being approached by unrelated personnel. And it is necessary to be equipped with corresponding protective equipment and emergency treatment facilities to prepare for emergencies.

As for transportation, do not slack off. The transportation vehicle must have good ventilation conditions to prevent the temperature in the compartment from being too high. At the same time, this compound must be properly fixed to avoid damage and leakage of the container due to bumps and collisions during transportation.

If a leak occurs during transportation, an emergency plan should be activated immediately. Relevant personnel need professional protective equipment to quickly evacuate the surrounding people and isolate the leakage area. Proper collection and handling of leaks must not be allowed to flow at will to avoid greater harm.

In short, the storage and transportation of 1-bromo-4-chloro-2-fluorobenzene is related to safety and the environment. Every step must be carried out with caution and must not be sloppy.

1-Bromo-4-chloro-2-fluorobenzene impact on the environment and people

1-Bromo-4-chloro-2-fluorobenzene is one of the organic halogenated aromatic hydrocarbons. The impact on the environment and human body should be discussed in detail.

First of all, its effect on the environment. This substance has certain chemical stability and is difficult to degrade in the natural environment, or causes it to accumulate in the environment. It may evaporate into the atmosphere. In the atmosphere, due to conditions such as light, or photochemical reactions, secondary pollutants are generated, which disturb the atmospheric chemical balance and can be transported over a long range, affecting the atmospheric environment in a wide area. If it is released into the water body, it can cause water pollution and affect the survival of aquatic organisms. Due to its fat solubility, or enrichment in aquatic organisms, it is transmitted and amplified through the food chain, endangering higher trophic organisms and destroying the balance of aquatic ecosystems. After entering the soil, it may affect the soil microbial activity and community structure, thereby interfering with soil ecological functions and affecting plant growth.

As for the impact on the human body. 1-Bromo-4-chloro-2-fluorobenzene may be toxic if ingested by humans through respiration, diet or skin contact. In the respiratory system, it can irritate the mucosa of the respiratory tract, causing cough, asthma, breathing difficulties, etc. Long-term exposure or increased risk of respiratory diseases. Its fat solubility makes it easy to pass through the cell membrane, accumulate in the body, or interfere with the human endocrine system, affect the synthesis, secretion and metabolism of hormones, and cause reproductive and developmental abnormalities. In the nervous system, it may cause neurotoxic symptoms such as headache, dizziness, fatigue, memory loss, etc. In severe cases, it may impair the normal function of the nervous system. And this substance may be potentially carcinogenic, and long-term exposure or increase the risk of cancer, but the exact carcinogenicity still needs more research to confirm.

In short, 1-bromo-4-chloro-2-fluorobenzene poses potential hazards to the environment and human body. It should be treated with caution, and monitoring and control should be strengthened to reduce its release in the environment and protect the ecological environment and human health.