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What is the chemical structure of 4-iodo-1-chloro-2- (4-ethoxybenzyl) benzene?
4-Iodo-1-chloro-2- (4-ethoxybenzyl) benzene is an organic compound. Its chemical structure can be inferred from the following analysis:
The parent of this compound is a benzene ring, which is connected with an iodo atom at position 4 of the benzene ring, a chloro atom at position 1, and a substituent at position 2. The substituent is (4-ethoxybenzyl), that is, a benzyl (benzyl, -CH -2 - the structure connected to the benzene ring), and the benzyl group is connected to the benzene ring at position 4 with an ethoxy (-O-CH 2O - CH 🥰).
According to the ancient saying, the structure of this compound can be regarded as a benzene ring as a base, with iodine atoms added in four places; chlorine atoms in one place; and a compound substituent in two places. This substituent is based on benzyl, and the benzyl ring attached to the benzyl group is connected in four places, and ethoxy groups. In this way, the chemical structure of 4-iodo-1-chloro-2 - (4-ethoxybenzyl) benzene is formed. This structure determines its physical and chemical properties, and may have unique uses and reaction characteristics in organic synthesis, pharmaceutical chemistry and other fields.
What are the physical properties of 4-iodo-1-chloro-2- (4-ethoxybenzyl) benzene?
4-Iodo-1-chloro-2 - (4-ethoxybenzyl) benzene, Chinese name or 4-iodo-1-chloro-2 - (4-ethoxybenzyl) benzene. The physical properties of this compound, let me tell you one by one.
Looking at its morphology, it is likely to be in a solid state at room temperature and pressure. Because its molecular structure contains rigid structural units such as benzene ring, the intermolecular force is strong, which makes it tend to exist in a solid state.
When it comes to the melting point, in view of the existence of benzene ring and halogen atoms such as iodine and chlorine, the intermolecular binding is close, and the melting point should not be low. However, in order to obtain accurate values, it still needs to be accurately determined by experiments. Halogen atoms have high electronegativity, and the benzene ring conjugate system enhances the intermolecular force, and it is inferred that the melting point may be between tens and hundreds of degrees Celsius.
In terms of boiling point, due to the relatively large weight of the molecule and the existence of various interactions, such as van der Waals force and dipole-dipole interaction, the boiling point should be quite high. Or it needs to be heated to hundreds of degrees Celsius before it can boil. The iodine atom and the chlorine atom in the molecule, due to the difference in electronegativity, cause the molecule to produce a certain dipole moment, which enhances the intermolecular force, which is one of the reasons for the increase in boiling point.
In terms of solubility, the compound is difficult to Water is a polar solvent, and this compound contains a large number of non-polar benzene ring structures. According to the principle of "similar miscibility", the force between it and water molecules is weak, so it is difficult to dissolve in water. However, in organic solvents, such as toluene, dichloromethane and other non-polar or weakly polar organic solvents, the solubility is good. The non-polar part of the benzene ring and the organic solvent can interact through van der Waals force, thereby enhancing the dissolution.
Density is also an important physical property. Due to the presence of atoms with relatively large atomic weights such as iodine and chlorine in the molecule, the density of the compound may be greater than that of common organic solvents. Iodine atoms have a large relative atomic weight and account for a high proportion in the molecule, which has The physical properties of 4-iodine-1-chloro-2- (4-ethoxybenzyl) benzene are determined by its molecular structure and are of great significance for its synthesis, separation and application.
What are the main uses of 4-iodo-1-chloro-2- (4-ethoxybenzyl) benzene?
4-Iodo-1-chloro-2- (4-ethoxybenzyl) benzene is also an organic compound. Such compounds have a wide range of uses and have their applications in various fields.
First, in the field of pharmaceutical chemistry, it is often an important intermediate. Drug development requires the construction of complex molecular structures. Due to its unique chemical structure, this compound can participate in a variety of organic synthesis reactions, assisting chemists in preparing drug molecules with specific biological activities. For example, by reacting with other compounds containing specific functional groups, the structure and properties of new compounds can be precisely regulated to meet the needs of drugs for specific diseases.
Second, in the field of materials science, it also shows its value. The development of organic optoelectronic materials is in the ascendant, and this compound can be chemically modified appropriately to integrate into the organic optoelectronic material system. Because it contains halogen atoms such as iodine and chlorine and benzene ring structure, it can affect the electron cloud distribution and conjugation system of materials, thereby regulating the optical and electrical properties of materials, or can be used to prepare functional materials for organic Light Emitting Diode (OLED), organic solar cells and other devices.
Third, in the field of fine chemicals, it can be used as a precursor for the synthesis of fine chemicals such as special fragrances and dyes. Due to the reactivity and stability given by its structure, it can be converted into fine chemicals with unique aroma or color characteristics through specific chemical reaction paths to meet the market demand for high-end and characteristic fine chemical products.
In summary, 4-iodo-1-chloro-2 - (4-ethoxybenzyl) benzene is an indispensable substance in the fields of drugs, materials and fine chemicals, and is of great significance to promote the progress and development of related industries.
What are the synthesis methods of 4-iodo-1-chloro-2- (4-ethoxybenzyl) benzene?
4-Iodo-1-chloro-2- (4-ethoxybenzyl) benzene is an organic compound. The methods for synthesizing this compound can be as follows:
First, the halogenated aromatic hydrocarbon is used as the starting material. 1-chloro-2- (4-ethoxybenzyl) benzene can be taken as the substrate to react with iodine reagents. Commonly used iodine substitutes include the combination of iodine element ($I_ {2} $) and oxidant. For example, in the presence of potassium persulfate ($K_ {2} S_ {2} O_ {8} $) and other oxidants, iodine element can undergo electrophilic substitution reaction with benzene ring, introducing iodine atoms. During the reaction, attention should be paid to the control of reaction conditions, such as reaction temperature, reaction time and the proportion of reactants. Generally speaking, in appropriate organic solvents, such as acetonitrile, dichloromethane, etc., the reaction can be carried out smoothly by controlling the temperature at room temperature to a moderate heating range and stirring the reaction for several hours. The reaction process is monitored by TLC (thin layer chromatography), and the reaction is completed when the raw material point is basically eliminated. Then the target product can be obtained by column chromatography and other means.
Second, the cross-coupling reaction catalyzed by palladium. The aromatic halide containing iodine can be prepared first, and then with the borate ester or boric acid derivative containing 4-ethoxybenzyl group, under the action of palladium catalyst, Suzuki-Miyaura cross-coupling reaction occurs. Commonly used palladium catalysts include tetra (triphenylphosphine) palladium ($Pd (PPh_ {3}) _ {4} $). The reaction system needs to be carried out under basic conditions. Commonly used bases include potassium carbonate ($K_ {2} CO_ {3} $), sodium carbonate ($Na_ {2} CO_ {3} $) and so on. The reaction solvent can be selected from a mixture of toluene, dioxane and water. The reaction temperature is usually controlled at about 80-120 ° C, and the reaction takes several hours. This reaction has good selectivity and yield. After the reaction, pure 4-iodo-1-chloro-2 - (4-ethoxybenzyl) benzene can be obtained through extraction, drying, column chromatographic separation and other steps.
Third, a method based on the Friedel-Crafts reaction. First, 4-ethoxybenzyl chloride and chlorobenzene are catalyzed by Lewis acid catalyst, such as anhydrous aluminum trichloride ($AlCl_ {3} $), to undergo Friedel-Crafts alkylation reaction to obtain 1-chloro-2 - (4-ethoxybenzyl) benzene. Subsequently, the obtained product is subjected to iodine substitution reaction. The iodine substitution method is as described above. The method of combining iodine elemental substance and oxidizing agent is used. After careful control of the reaction conditions and separation and purification steps, the target compound 4-iodo-1-chloro-2 - (4-ethoxybenzyl) benzene can finally be obtained.
What are the precautions for storing and transporting 4-iodo-1-chloro-2- (4-ethoxybenzyl) benzene?
4 - iodo - 1 - chloro - 2 - (4 - ethoxybenzyl) benzene is an organic compound. During storage and transportation, many matters need to be paid attention to.
The first thing to bear the brunt is the storage conditions. Because of its nature or affected by temperature and humidity, it should be placed in a cool, dry and well-ventilated place. If the temperature is too high, it may cause the compound to decompose and deteriorate; if the humidity is too high, it may cause chemical reactions that damage its purity and quality. And it needs to be kept away from fire and heat sources. It may be flammable to avoid fire hazards.
Storage containers are also essential. Containers with good corrosion resistance and sealing should be selected. Glass containers may be a good choice because of their stable chemical properties and are not easy to react with compounds. At the same time, good sealing can prevent compounds from evaporating and reacting with air components. Be sure to ensure that the container label is clear, and key information such as compound name, specification, storage date, etc. are marked for easy identification and management.
The transportation process should also not be taken lightly. Relevant regulations and standards must be followed, and proper packaging is required. Wrap with suitable cushioning materials to prevent the container from breaking due to collision and vibration. And the transportation means must also maintain suitable environmental conditions, such as temperature and humidity control. Transport personnel should be professionally trained, familiar with the characteristics of the compound and emergency treatment methods, and can respond quickly and correctly in case of emergencies on the way.
This compound may be toxic and dangerous, and personnel protection is essential during storage and transportation. Wear appropriate protective equipment when in contact, such as gloves, goggles, protective clothing, etc., to avoid skin contact and inhalation to ensure personal safety.