4 Phenoxybenzotrifluoride
Fluoride
4-Phenoxybenzotrifluoride
Chemical Formula C13H9F3O
Molecular Weight 240.205
Appearance Colorless to light yellow liquid
Boiling Point 268 - 270 °C
Density 1.248 g/mL at 25 °C
Solubility In Water Insoluble
Solubility In Organic Solvents Soluble in common organic solvents like ethanol, ether
Vapor Pressure Low vapor pressure
Flash Point 108 °C
FAQ

What are the main uses of 4-Phenoxybenzotrifluoride?

4-Phenoxy trifluorotoluene, which has a wide range of uses. In the field of organic synthesis, it is often used as a key intermediate. Due to its unique chemical structure, it contains phenoxy and trifluoromethyl groups, giving it special chemical activity and properties.

In the field of medical chemistry, using this as a raw material, through a series of delicate chemical reactions, a variety of drug molecules with specific biological activities can be prepared. The introduction of trifluoromethyl groups may significantly change the lipophilicity, metabolic stability and biological activity of compounds, thereby helping to develop new drugs with high efficiency and low toxicity.

In the field of materials science, 4-phenoxy trifluorotoluene also has important functions. It can participate in the synthesis of polymer materials, such as the preparation of polymers with special properties. With its structural characteristics, it may be able to improve the thermal stability, chemical stability and weather resistance of polymers, etc., so it shows potential application value in aerospace, electronics and electrical appliances and other fields that require strict material properties.

In pesticide chemistry, it can be used as an intermediate to synthesize new pesticides. The presence of trifluoromethyl may enhance the toxicity of pesticides to pests, improve the selectivity of targets, and help reduce pesticide residues in the environment, in line with the current trend of green pesticides.

In short, 4-phenoxy trifluorotoluene plays an indispensable role in many important fields such as organic synthesis, medicine, materials, and pesticides, and has made great contributions to promoting technological progress and innovative development in various fields.

What are the physical properties of 4-Phenoxybenzotrifluoride?

4-Phenoxytrifluorotoluene is one of the organic compounds. Its physical properties are particularly important and are listed below.

First appearance, under normal temperature and pressure, this substance is often colorless to light yellow transparent liquid, clear and free of impurities, and its radiant luster can be seen under light.

When it comes to boiling point, it is about 260-262 ° C. At this temperature, the compound gradually changes from liquid state to gaseous state, the intermolecular force weakens, and the molecules escape from the liquid surface. The value of boiling point is of great significance in chemical processes such as material separation and purification, and distillation and other processes can be designed according to it.

In terms of melting point, it is roughly about -22 ° C. When the temperature drops below the melting point, the thermal motion of the molecules slows down, the arrangement becomes more orderly, and the substance solidifies from the liquid state to the solid state. This property needs to be paid attention to during storage and transportation to avoid changes in the phase state due to temperature fluctuations.

The density is about 1.24 g/cm ³, which is higher than the density of water at 1 g/cm ³. If mixed with water, it will sink underwater. This property is an important consideration when it comes to liquid-liquid separation and other operations.

In terms of solubility, 4-phenoxy trifluorotoluene is insoluble in water, because its molecular structure contains hydrophobic benzene ring and trifluoromethyl, and the force between water molecules is weak. However, it is soluble in common organic solvents, such as ethanol, ether, acetone, etc., and can be mutually soluble with it. This solubility is very critical in organic synthesis reactions, and is often used as a reaction medium or to dissolve reactants to facilitate the smooth progress of the reaction.

In addition, the vapor pressure of this compound is low, indicating that its volatility is relatively weak, and it is not easy to evaporate into the air in large quantities at room temperature, which has certain advantages in terms of operating environment safety. However, its vapor still has a certain pressure. In high temperature or closed environment, it is still necessary to pay attention to the risk of volatilization accumulation.

The physical properties of 4-phenoxy trifluorotoluene have their own unique significance and applications. They are all elements that cannot be ignored in many fields such as chemical industry, materials, and scientific research.

Is 4-Phenoxybenzotrifluoride chemically stable?

The chemical stability of 4-phenoxy-trifluorotoluene needs to be examined in detail from various angles.

First look at its molecular structure, the phenoxy group is connected to the trifluoromethyl group. In the phenoxy group, the benzene ring has a conjugated system, and the electron cloud distribution is relatively uniform and stable, which gives the molecule a certain stability. The π electron cloud of the benzene ring can disperse the external energy acting on the molecule, making it difficult to easily break the valence bond in the face of general chemical environment.

Speaking of trifluoromethyl, the fluorine atom is extremely electronegative, and the three fluorine atoms are connected to the methyl group, which makes the trifluoromethyl electron cloud strongly biased towards the fluorine atom. This not only increases the polarity of the molecule, but also forms a relatively tight spatial structure due to the small radius of the fluorine atom and the large electronegativity, which plays a certain protective role in the benzene ring and the whole molecule, and improves its stability to a certain extent.

In common chemical reaction scenarios, if the environment is mild and there are no extreme conditions such as strong oxidants, strong reducing agents or strong acids and bases, 4-phenoxy trifluorotoluene can maintain a relatively stable state. Because there are no active functional groups that are easily reactive in its structure, such as carbon-carbon double bonds, aldehyde groups, etc., these functional groups are easy to participate in addition and oxidation reactions under mild conditions.

However, if placed in a harsh chemical environment, such as high temperature and catalyzed by strong Lewis acid, the phenoxy group on the benzene ring may participate in the reaction due to the change of electrophilic substitution activity. Although trifluoromethyl is relatively stable, in the presence of high temperature, strong ionizing radiation or specific catalysts, fluorine atoms may also undergo reactions such as substitution or removal, resulting in changes in molecular structure and loss of stability.

In summary, 4-phenoxy trifluorotoluene is chemically stable under generally mild conditions, but its stability will be challenged under extreme chemical conditions.

What is 4-Phenoxybenzotrifluoride production method?

The preparation method of 4-phenoxy trifluorotoluene has always relied on the technique of chemical synthesis. The method follows the path of organic synthesis, and various reactions are used to form this substance.

One of the common methods is to use trifluoromethylbenzene as the starting material. First, trifluoromethylbenzene is halogenated with a halogenating agent such as bromine or chlorine under suitable reaction conditions, such as light or the presence of a catalyst. This reaction can introduce a halogen atom, mostly a bromine atom or a chlorine atom, into the benzene ring to obtain halogenated trifluoromethylbenzene.

Next, the obtained halogenated trifluoromethylbenzene is reacted with a phenol salt. Phenol salts can be obtained by the reaction of phenol with a base such as sodium hydroxide. In a suitable solvent, such as dimethylformamide (DMF) and other aprotic polar solvents, under heating and catalysts such as copper salts, nucleophilic substitution reactions are carried out. The halogen atom is replaced by a phenoxy group, and 4-phenoxy trifluorotoluene is obtained.

Another way is to use trifluoromethylbenzoic acid as the starting material. Trifluoromethylbenzoic acid is first reduced to trifluoromethylbenzyl alcohol through an appropriate reducing agent, such as lithium aluminum hydride. Then trifluoromethylbenzyl alcohol is reacted with a halogenating agent to obtain a halogenated trifluoromethylbenzyl compound. Subsequently, the nucleophilic substitution reaction between the halogenate and phenol occurs under basic conditions and the help of a phase transfer catalyst, and 4-phenoxy trifluorotoluene can also be obtained.

Or, using trifluoromethylaniline as the starting material, the diazonium salt is obtained by the diazotization reaction. The diazonium salt reacts with phenol under appropriate conditions, and the molecular structure of the target product 4-phenoxy trifluorotoluene can also be constructed. All methods have their own advantages and disadvantages. The actual preparation needs to be based on the availability of raw materials, cost, and difficulty of reaction conditions.

What are the precautions when storing and transporting 4-Phenoxybenzotrifluoride?

4-Phenoxytrifluorotoluene is also an organic compound. During storage and transportation, many matters must be paid attention to.

When storing, the first choice of environment. It must be placed in a cool and ventilated place. Because the substance is easily dangerous when heated, high temperature can promote its chemical reaction, damage its quality, or even cause safety problems. The temperature of the warehouse should be controlled within an appropriate range, and must not be too high.

Furthermore, the substance must be stored in isolation from oxidants, acids, bases, etc. Contact with these substances can easily cause violent chemical reactions, or burn or explode, which is extremely harmful.

Packaging is also crucial. It is necessary to ensure that the packaging is complete and sealed. If the packaging is damaged, the substance is easy to evaporate and escape, one is to pollute the environment, and the other is to react in the air or with other substances, endangering safety.

When transporting, the transportation vehicle is selected as a special person, and the vehicle is in good condition, and various safety facilities are complete. During transportation, protect against sun exposure, rain, and avoid high temperature. Driving should be stable, and do not brake or turn sharply to avoid package collision damage.

Escort personnel must also be professional and conscientious, familiar with the characteristics of the substance and emergency response methods. In case of emergencies, they can respond quickly and properly to ensure the safety of transportation.

All of these are important items that should not be ignored during the storage and transportation of 4-phenoxytrifluorotoluene, and must be treated with caution to avoid danger.