Chemical Formula | C8H5ClF4 |
Molecular Weight | 226.57 |
Appearance | Colorless to light yellow liquid |
Boiling Point | 190 - 192 °C |
Density | 1.404 g/cm³ |
Solubility | Insoluble in water, soluble in organic solvents |
Flash Point | 75 °C |
Refractive Index | 1.447 |
Stability | Stable under normal conditions |
Chemical Formula | C8H5ClF4 |
Molecular Weight | 214.57 |
Appearance | Liquid |
Color | Colorless to light yellow |
Odor | Pungent odor |
Boiling Point | Around 185 - 187°C |
Density | Approx. 1.42 - 1.45 g/cm³ |
Solubility In Water | Insoluble |
Solubility In Organic Solvents | Soluble in many organic solvents like dichloromethane, toluene |
Flash Point | Around 65 - 70°C |
Vapor Pressure | Low vapor pressure |
What are the physical properties of 2-Trifluoromethyl-4-fluorobenzyl chloride?
2-Trifluoromethyl-4-fluorobenzyl chloride is an important compound in organic chemistry. Its physical properties are unique and have many characteristics, as detailed below.
First of all, its appearance, under room temperature and pressure, 2-trifluoromethyl-4-fluorobenzyl chloride is mostly colorless to pale yellow transparent liquid. This color and state can be visually distinguished by the naked eye during chemical production and experimental operation, providing basic knowledge for subsequent work.
When it comes to the boiling point, the boiling point of this compound is about a specific temperature range. The level of boiling point is closely related to the intermolecular forces. In the molecular structure of 2-trifluoromethyl-4-fluorobenzyl chloride, due to the high electronegativity of these atoms and fluorine atoms, the intermolecular forces change, which in turn affects the boiling point. The exact value of its boiling point is of great significance in separation, purification and control of reaction conditions. In separation operations such as distillation, the temperature can be accurately set according to the boiling point to achieve effective separation from other substances.
Melting point is also one of the important physical properties. The melting point of this substance is also in a specific range. The characteristics of the melting point are related to the transformation of its physical state at different temperatures. When the temperature drops below the melting point, 2-trifluoromethyl-4-fluorobenzyl chloride gradually changes from liquid to solid. This property needs to be taken into account during storage and transportation. If the ambient temperature is too low, it will cause solidification, or it will cause inconvenience to access and subsequent use.
In addition, the density of 2-trifluoromethyl-4-fluorobenzyl chloride also has a specific value. The density reflects the quality of the substance per unit volume. Density data is indispensable in the material measurement process of chemical production. According to the density, the quality of a certain volume of the substance can be accurately calculated to ensure the accurate ratio of the reactants, so as to ensure the smooth progress of the reaction and the stability of the product quality.
In terms of solubility, 2-trifluoromethyl-4-fluorobenzyl chloride has good solubility in organic solvents, such as common ether, dichloromethane, etc. However, it has poor solubility in water. This difference in solubility stems from the hydrophobicity of its molecular structure. In organic synthesis reactions, a suitable solvent is often selected according to its solubility characteristics to create an environment conducive to the reaction.
Volatility, 2-trifluoromethyl-4-fluorobenzyl chloride has a certain volatility. The existence of volatility makes it necessary to pay attention to safety measures such as ventilation during operation. If the vapor accumulates to a certain concentration in the air, it may cause safety hazards. At the same time, volatility also affects its storage, and it needs to be sealed to prevent material volatilization and loss.
In short, the many physical properties of 2-trifluoromethyl-4-fluorobenzyl chloride are interrelated and affect its application in chemical industry, scientific research and other fields. When operating and using, it must be carefully considered.
What are the chemical properties of 2-Trifluoromethyl-4-fluorobenzyl chloride?
2-Trifluoromethyl-4-fluorobenzyl chloride is one of the organic compounds. Its chemical properties are unique and it plays a key role in many chemical reactions.
This compound has the characteristics of active halogenated hydrocarbons. Chlorine atoms are highly active and easy to initiate nucleophilic substitution reactions. For example, under basic conditions with alcohols, chlorine atoms can be replaced by alkoxy groups to form corresponding ether compounds. When reacted with amines, nitrogen-containing derivatives can be formed, which is widely used in the field of organic synthesis and preparation of pharmaceutical intermediates.
Due to the presence of trifluoromethyl and fluorine atoms in the molecule, the compound has special physicochemical properties. Fluorine atoms are highly electronegative, and trifluoromethyl has a strong electron-absorbing effect, which increases the polarity of molecules and affects their solubility and stability. In organic solvents, the solubility is specific, and it is more soluble in polar organic solvents than some fluorine-free analogs. And because of the presence of fluorine atoms and trifluoromethyl, the chemical stability of compounds is enhanced, and under some chemical reaction conditions, it is more resistant to structural changes caused by external factors.
Its chemical activity is also reflected in its ability to participate in metal-catalyzed coupling reactions. Under transition metal catalysis, it is coupled with specific organometallic reagents to realize the construction of carbon-carbon bonds or carbon-heteroatom bonds, providing an effective way for the synthesis of complex organic molecules, which is of great significance in the fields of materials science and fine chemistry.
Under some specific conditions, 2-trifluoromethyl-4-fluorobenzyl chloride may be eliminated to remove hydrogen chloride and form products containing unsaturated bonds, providing a variety of reaction paths for organic synthesis and enriching the preparation methods of organic compounds.
What are the common synthesis methods of 2-Trifluoromethyl-4-fluorobenzyl chloride?
2-Trifluoromethyl-4-fluorobenzyl chloride is also a common intermediate in organic synthesis. Its common synthesis methods follow several paths.
First, 2-trifluoromethyl-4-fluorobenzoic acid is used as the starting material. First, the acid is esterified with alcohols, such as methanol, under the catalysis of acid to generate corresponding esters. The acid catalyst used is sulfuric acid, p-toluenesulfonic acid and the like. The reaction needs to be heated and refluxed, and it takes several times to make the esterification reaction reach the desired degree. Later, a reducing agent, such as sodium borohydride-lithium chloride system, is used to reduce the ester to an alcohol. The reaction conditions are mild and can be carried out at low temperature to obtain 2-trifluoromethyl-4-fluorobenzyl alcohol. Then the alcohol is reacted with a chlorination reagent, such as thionyl chloride, in an appropriate solvent, such as dichloromethane, heated to reflux, and the benzyl alcohol hydroxyl group is replaced by a chlorine atom, then 2-trifluoromethyl-4-fluorobenzyl chloride is obtained.
Second, 2-trifluoromethyl-4-fluorotoluene is used as the starting material. Halogenation reaction can be used, with N-chlorosuccinimide (NCS) as chlorination reagent and azobisisobutyronitrile (AIBN) as initiator, the reaction can be heated in an inert solvent such as carbon tetrachloride. Light or heating initiates a free radical reaction, so that the benzyl hydrogen of toluene is replaced by a chlorine atom to obtain the target product. This reaction has good selectivity and can better obtain 2-trifluoromethyl-4-fluorobenzyl chloride.
Or, with the corresponding aromatic compound, trifluoromethyl and fluorine atoms are introduced through a nucleophilic substitution reaction, and then chlorine atoms are introduced at the benzyl position. This path requires fine regulation of reaction steps and reagent dosage according to specific raw materials and reaction conditions to obtain the desired product.
All synthesis methods have their own advantages and disadvantages. In practical application, the choice should be weighed according to factors such as raw material availability, cost, reaction conditions and yield.
What are the main uses of 2-Trifluoromethyl-4-fluorobenzyl chloride?
2-Trifluoromethyl-4-fluorobenzyl chloride is an important raw material for organic synthesis and has a wide range of uses.
First, in the field of medicinal chemistry, this compound plays a key role. The creation of many drugs relies on it as a starting material to participate in the construction of drug-active molecular structures. Because it contains fluorine atoms and benzyl chloride groups, it endows molecules with unique physical and chemical properties and biological activities. For example, when developing new antibacterial drugs, 2-trifluoromethyl-4-fluorobenzyl chloride can be used as a key intermediate to introduce specific structures to enhance the binding force between drugs and bacterial targets and improve antibacterial efficacy.
Second, in the field of pesticides, 2-trifluoromethyl-4-fluorobenzyl chloride also plays an important role. It is used to synthesize high-efficiency insecticides, fungicides and other pesticide products. Its special chemical structure can make pesticides highly selective and active to pests or pathogens, and due to the presence of fluorine atoms, the stability and environmental adaptability of pesticides are improved, the frequency of application is reduced, and the impact on the environment is reduced.
Furthermore, in the field of materials science, 2-trifluoromethyl-4-fluorobenzyl chloride can be used to prepare functional polymer materials. Through chemical reactions, it is introduced into the polymer chain to impart special properties such as chemical resistance and low surface energy to the material. For example, the manufacture of special coating materials can improve the material's resistance to harsh chemical environments, and is used in aerospace, automotive and other fields.
To sum up, 2-trifluoromethyl-4-fluorobenzyl chloride, with its unique structure, is indispensable in many fields such as medicine, pesticides, and materials science, and promotes the development and innovation of technologies in various fields.
2-Trifluoromethyl-4-fluorobenzyl chloride during storage and transportation
2-Trifluoromethyl-4-fluorobenzyl chloride is a commonly used raw material for organic synthesis. When storing and transporting it, many matters need to be carefully paid attention to.
When storing, choose the first environment. It should be placed in a cool, dry and well-ventilated place. This is because it is volatile and irritating, in a warm and humid place, it is easy to increase volatilization, or react with water vapor, which will damage its quality. In addition, it must be kept away from fires and heat sources to prevent the risk of combustion or explosion. Because of its active chemical properties, it can be exposed to open flames, hot topics, or violent reactions.
The substance should be stored separately from oxidizing agents, alkalis, etc., and must not be mixed. Gein 2-trifluoromethyl-4-fluorobenzyl chloride meets with an oxidizing agent, or triggers an oxidation reaction, causing the composition to change; in contact with alkalis, chemical reactions may also occur, forming new substances, causing their failure or potential safety hazards.
As for transportation, the packaging must be tight and stable. Choose suitable packaging materials to ensure that there is no leakage during transportation. Because it is toxic and corrosive, once it leaks, it may endanger the safety of transporters and pollute the surrounding environment. During transportation, the speed should not be too fast, avoid sudden braking and bumps to prevent package damage.
And transportation personnel must be professionally trained and familiar with the characteristics and emergency treatment methods of 2-trifluoromethyl-4-fluorobenzyl chloride. If there is a sudden leakage on the way, it can be responded to quickly and properly to reduce the harm. In this way, when storing and transporting 2-trifluoromethyl-4-fluorobenzyl chloride, pay attention to the above things to ensure safety and quality of the substance.