3 Bromo 2 Methylbenzotrifluoride
Fluoride
3-Bromo-2-methylbenzotrifluoride
Chemical Formula C8H6BrF3
Molecular Weight 239.03
Appearance Liquid (usually)
Boiling Point Around 205 - 207 °C
Density Typically around 1.5 - 1.6 g/cm³
Solubility In Water Insoluble
Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane
Vapor Pressure Low at room temperature
Purity Can be available in various purities, e.g., 95%+ in commercial grades
FAQ

What are the chemical properties of 3-Bromo-2-methylbenzotrifluoride?

3-Bromo-2-methyl trifluorotoluene, which is an organic compound, has many unique chemical properties. Among this substance, bromine atoms are active and can initiate a variety of substitution reactions. Due to the high electronegativity of bromine atoms, it can cause changes in the density of adjacent and para-position electron clouds, and nucleophiles are easy to attack it. If it is with sodium alcohol under suitable conditions, nucleophilic substitution can occur, and bromine atoms are replaced by alkoxy groups to form corresponding ether compounds.

Furthermore, methyl groups have electron-giving effects, which can affect the distribution of electron clouds in the benzene ring, making the benzene ring more prone to electrophilic substitution reactions. Compared with benzene, its electrophilic substitution activity has increased, and the adjacent and para-position of methyl groups are the reaction activity check points.

Trifluoromethyl, on the other hand, is extremely electronegative and has a strong electron-absorbing effect. It not only reduces the electron cloud density of the benzene ring, making the electrophilic substitution reaction more difficult, but also has a significant impact on molecular polarity, making the compound unique in solubility in some organic solvents. At the same time, the presence of trifluoromethyl enhances the stability of the compound due to the high C-F bond energy.

In addition, 3-bromo-2-methyl trifluorotoluene may undergo free radical reactions under light or heating conditions. Bromine atoms can be homogenized under specific conditions to generate bromine radicals, which in turn triggers a series of free radical chain reactions. Its chemical properties make it widely used in the field of organic synthesis and can be used as a key intermediate for the preparation of many organic compounds such as medicine, pesticides, and materials.

What are the main uses of 3-Bromo-2-methylbenzotrifluoride?

3-Bromo-2-methyltrifluorotoluene has a wide range of uses. It is a crucial intermediate in the field of organic synthesis. With its special chemical structure, it can participate in multiple chemical reactions, and then construct many complex organic compounds.

In the field of pharmaceutical chemistry, it can be used as a key starting material to help develop new drugs. Due to its unique chemical properties, it may endow drugs with better biological activity, higher selectivity, or enhance the stability of drugs, which is of great significance for improving the efficacy and quality of drugs.

In the field of materials science, its use should not be underestimated. It can be integrated into the structure of polymer materials through specific reactions, giving the materials excellent properties such as chemical corrosion resistance and heat resistance, and then expanding the application scenarios of materials, such as high-end coatings, special engineering plastics, etc.

Furthermore, in the field of fine chemicals, 3-bromo-2-methyltrifluorotoluene also plays an important role. It can be used to prepare various fine chemicals, such as special fragrances, dye intermediates, etc., which greatly enriches the types of fine chemical products and meets the needs of different industries for special chemicals.

In summary, 3-bromo-2-methyltrifluorotoluene, with its unique chemical structure and properties, has shown indispensable value in many fields such as organic synthesis, medicinal chemistry, materials science, and fine chemicals, and has made significant contributions to the development of related industries.

What are 3-Bromo-2-methylbenzotrifluoride synthesis methods?

There are several common methods for preparing 3-bromo-2-methyltrifluorotoluene.

First, 2-methyltrifluorotoluene is used as the starting material and obtained by bromination. This reaction requires the selection of a suitable brominating reagent, such as bromine (\ (Br_ {2}\)). In the reaction system, a catalyst such as iron powder (\ (Fe\)) or iron tribromide (\ (FeBr_ {3}\)) is often introduced. Under the condition of heating or light, bromine reacts with 2-methyltrifluorotoluene. Because methyl is an ortho-para-locator, although both ortho and para-sites may react, due to factors such as steric hindrance, bromine atoms can be mainly substituted in methyl ortho-sites under suitable conditions to generate 3-bromo-2-methyl trifluorotoluene. The reaction equation is roughly as follows:\ (C_ {8} H_ {7} F_ {3} + Br_ {2}\ xrightarrow [] {Fe or FeBr_ {3}, heating or lighting} C_ {8} H_ {6} BrF_ {3} + HBr\).

Second, aromatics containing corresponding substituents can be prepared first, and then the target product can be prepared by trifluoromethylation. For example, with 2-methyl bromobenzene as the raw material, trifluoromethyl is first introduced by a suitable method. Trifluoromethylation reagents, such as zinc trifluoromethyl halide (\ (CF_ {3} ZnX\)), etc., can be used under the action of transition metal catalysts such as palladium (\ (Pd\)) catalysts, a coupling reaction occurs to introduce trifluoromethyl into the benzene ring to generate 3-bromo-2-methyl trifluorotoluene. The reaction conditions are quite critical, and factors such as temperature, solvent and catalyst dosage need to be strictly controlled to improve the reaction yield and selectivity.

Or, it can be obtained by multi-step reaction conversion from other compounds containing similar structures. The appropriate benzene ring structure is first constructed, and then methyl, bromine atoms and trifluoromethyl groups are gradually introduced. Each step of the reaction needs to be carefully designed and regulated to ensure that the reaction proceeds in the expected direction, and finally a higher purity 3-bromo-2-methyl trifluorotoluene product is obtained.

3-Bromo-2-methylbenzotrifluoride what are the precautions in storage and transportation?

3-Bromo-2-methyl trifluorotoluene is also an organic compound. During storage and transportation, many matters must be paid attention to.

First words storage, this compound should be placed in a cool, dry and well ventilated place. Cover because of its volatility and certain chemical activity, warm and humid places, easy to cause changes in its properties, or even cause chemical reactions, damage its quality. And must be away from fire, heat sources, open flames, hot topics, this compound may have the risk of combustion and explosion.

Furthermore, the storage place should be separated from oxidants, reducing agents, acids, bases, etc., and must not be mixed. Due to its chemical properties, it encounters with such substances, or reacts violently, endangering safety. Storage containers are also crucial, and must be sealed to prevent volatilization and leakage. Choose containers of suitable materials, such as corrosion-resistant metal or special plastic containers, to avoid leakage caused by erosion of the container.

As for transportation, the transportation vehicle must be clean, dry, and free of other chemical substances to avoid impurities from mixing and triggering reactions. During transportation, close protection should be taken to prevent collision and friction. Because of its certain danger, transportation personnel must undergo professional training and be familiar with its characteristics and emergency treatment methods. During transportation, warning signs should also be hung as required to indicate its dangerous nature, so that others can be vigilant.

All of these are important items that should not be ignored when storing and transporting 3-bromo-2-methyltrifluorotoluene. Only with caution can security be guaranteed.

3-Bromo-2-methylbenzotrifluoride impact on the environment and human health?

3-Bromo-2-methyl trifluorotoluene is also an organic compound. Its impact on the environment and human health cannot be ignored.

As far as the environment is concerned, if this compound is released in nature, or transported and transformed between air, water and soil. In the atmosphere, it may interact with free radicals and participate in photochemical reactions, which may disturb air quality. If it flows into water bodies, or due to hydrophobicity, it accumulates in bottom mud or aquatic organisms, endangering the balance of aquatic ecosystems, hindering the growth and reproduction of aquatic animals and plants, and even causing changes in population structure. As for soil, it may affect the activity and community structure of soil microorganisms, which is detrimental to soil fertility and ecological functions.

As for human health, it is toxic to a certain extent. It may be ingested through breathing, skin contact or accidental ingestion, or endanger health. Respiratory inhalation, or irritation of respiratory mucosa, causing cough, asthma, breathing difficulties and other symptoms. Skin contact, or cause contact dermatitis, with redness, swelling, itching, pain. If ingested by mistake, it may damage the digestive system, cause nausea, vomiting, abdominal pain, etc. And long-term exposure to this compound may cause mutation and cancer, causing damage to human genetic material and increasing the risk of cancer. Therefore, in the production, use and disposal of 3-bromo-2-methyltrifluorotoluene, it is necessary to adhere to safety regulations and take effective protection and environmental protection measures to reduce its harm to the environment and human health.