Chemical Formula | C13H11ClFNO |
Molecular Weight | 251.688 g/mol |
Appearance | Solid (predicted) |
Melting Point | N/A |
Boiling Point | N/A |
Solubility In Water | Low (predicted) |
Logp | 4.06 (predicted) |
Flash Point | N/A |
Density | N/A |
Vapor Pressure | N/A |
Pka | N/A |
Chemical Formula | C13H11ClFNO |
Molecular Weight | 251.69 |
Appearance | Solid (usually) |
Melting Point | Data needed |
Boiling Point | Data needed |
Solubility In Water | Low (likely) |
Solubility In Organic Solvents | Moderate to high in common organic solvents |
Density | Data needed |
Flash Point | Data needed |
Pka | Data needed |
Vapor Pressure | Data needed |
What are the chemical properties of 3-chloro-4- (3-fluorobenzyloxy) aniline
3-Chloro-4- (3-fluorobenzoxy) aniline is an organic compound with a unique molecular structure, which is cleverly connected by chlorine atoms, fluorine atoms, benzoxy groups and aniline groups.
When it comes to physical properties, at room temperature, it may be a solid, but due to the influence of different groups in the molecule, the melting point and boiling point are different. The aromatic ring structure and the existence of various substituents make the intermolecular forces more complex, or the melting point and boiling point are higher than those of ordinary simple aromatic hydrocarbons. In addition, due to the change in molecular polarity, it may have certain solubility in common organic solvents.
In terms of chemical properties, amino groups are extremely active and can undergo many reactions. For example, it can react with acids to form corresponding salts, which is a typical basic reaction of amino groups. Moreover, amino groups can participate in nucleophilic substitution reactions, and under appropriate conditions, combine with electrophilic reagents such as halogenated hydrocarbons to form new carbon-nitrogen bonds. Furthermore, although the chlorine atom on the benzene ring is affected by the aromatic ring, its activity is slightly lower than that of the halogen atom of aliphatic halogenated hydrocarbons, but under specific conditions, such as strong nucleophilic reagents and high temperatures, substitution reactions can occur, and chlorine atoms can be replaced by other groups. At the same time, the oxygen atom of the benzoxy part has lone pairs of electrons, which can exhibit certain nucleophilicity and participate in partial reactions. In addition, the fluorine atom on the aromatic ring, due to its high electronegativity, will affect the electron cloud density of the benzene ring, which will change the regioselectivity of the electrophilic substitution reaction on the benzene ring.
Overall, 3-chloro-4- (3-fluorobenzoxy) aniline has rich chemical properties and may have broad application prospects in the field of organic synthesis. It can be used as a key intermediate to prepare many organic compounds with special properties.
What is the main use of 3-chloro-4- (3-fluorobenzyloxy) aniline?
3-Chloro-4- (3-fluorobenzoxy) aniline is a crucial raw material in organic synthesis chemistry. In today's chemical synthesis field, its uses are quite extensive, especially in the creation of medicines and pesticides, playing a pivotal role.
In the field of medicine, it is often used as a key intermediate to synthesize drug molecules with specific biological activities. The ingenious combination of chlorine atoms, fluorobenzoxy groups and aniline groups in its structure endows the derived drugs with unique physicochemical properties and biological activities. With the delicate means of organic synthesis, various functional groups can be modified and expanded, and then complex and diverse drug candidates can be constructed to deal with the challenges of many diseases such as anti-infection and anti-tumor.
As for the field of pesticides, 3-chloro-4- (3-fluorobenzoxy) aniline also shows extraordinary value. After rational molecular design and reaction transformation, it can be made into an efficient and low-toxic pesticide active ingredient. Such ingredients can cause specific interference to the physiological functions of pests, so as to achieve accurate pest control, escort the harvest of agriculture, and at the same time conform to the current green agricultural development concept, and strive to reduce the adverse impact on the ecological environment.
In addition, in materials science and other related fields, due to its special structure, this compound may also provide a unique structural unit for the research and development of new functional materials, injecting new vitality into the innovation and development of this field. In short, 3-chloro-4- (3-fluorobenzoxy) aniline has great application potential and research value in many fields due to its unique chemical structure.
What are the synthesis methods of 3-chloro-4- (3-fluorobenzyloxy) aniline
The synthesis method of 3-chloro-4- (3-fluorobenzoxy) aniline is an important research in the field of organic synthesis. According to the ancient classical Chinese style of "Tiangong Kaiwu", the outline is as follows.
First, it can be obtained from 3-chloro-4-hydroxyaniline and 3-fluorobenzyl halide in an alkaline environment by nucleophilic substitution in a suitable solvent. For example, 3-chloro-4-hydroxyaniline is placed in a solvent such as acetonitrile, a base such as potassium carbonate is added, stirred well, and then 3-fluorobenzyl halide is slowly added dropwise, and the reaction is continuously stirred at an appropriate temperature. In this process, the base can capture the hydroxyl hydrogen of 3-chloro-4-hydroxyaniline to form an oxygen anion, and then launch a nucleophilic attack on the benzyl carbon of 3-fluorobenzyl halide, and the halogen ion leaves, resulting in the target product 3-chloro-4 - (3-fluorobenzoxy) aniline.
Second, 3-chloro-4-nitrophenol can also be used as a starting material. First, it undergoes a similar nucleophilic substitution reaction with 3-fluorobenzyl halide to generate 3-chloro-4- (3-fluorobenzoxy) nitrobenzene. Subsequently, the nitro group is reduced to an amino group by a suitable reducing agent, such as a combination of iron powder and hydrochloric acid, or hydrogen catalyzed by palladium carbon, to obtain 3-chloro-4- (3-fluorobenzoxy) aniline. Taking hydrogen reduction as an example, 3-chloro-4- (3-fluorobenzoxy) nitrobenzene is placed in a reactor containing a palladium-carbon catalyst, hydrogen is introduced, and appropriate pressure and temperature are controlled. The nitro group gradually obtains electrons and converts them into amino groups to achieve the synthesis of the product.
Furthermore, other related organic synthesis paths can also be considered, depending on the availability of raw materials, the difficulty of controlling reaction conditions, and cost-effectiveness, etc., to flexibly choose and optimize to achieve the efficient synthesis of 3-chloro-4- (3-fluorobenzoxy) aniline.
What is the market outlook for 3-chloro-4- (3-fluorobenzyloxy) aniline?
3-Chloro-4- (3-fluorobenzyloxy) aniline is a fine chemical in the field of organic chemistry. Looking at its market prospects, there are significant needs and development opportunities in many fields.
In the field of medicine, such aniline derivatives containing specific substituents are often key intermediates in drug synthesis. With the continuous advancement of pharmaceutical research and development, the demand for compounds with unique structures and activities is increasing. Taking the development of anti-cancer drugs as an example, the design of many new targeted drugs requires the use of such structural units, which are chemically modified and optimized to endow the drugs with better biological activity, targeting and pharmacokinetic properties. Therefore, under the upsurge of innovative drug research and development, its market demand as a basic raw material is expected to rise steadily.
In the field of materials science, it also has potential application value. For example, in organic optoelectronic materials, the special electronic structure and chemical properties of such compounds may improve the photoelectric properties of materials, such as improving charge transport efficiency and enhancing luminous efficiency. With the rapid development of organic electronics, the demand for high-performance organic optoelectronic materials is rising, and 3-chloro-4 - (3-fluorobenzoxy) aniline as a potential raw material may usher in a broader market space.
Furthermore, in the field of pesticides, efficient, low-toxic and environmentally friendly pesticide varieties can be derived through rational structural modification. At present, the global attention to food safety and environmental protection is increasing, and the research and development trend of new pesticides is green and efficient. This compound may become an important starting material for the development of such new pesticides, thereby driving the growth of its market demand.
However, its market development also faces challenges. The complexity of the synthesis process or the high production cost limit its large-scale application. And the fine chemicals market is fiercely competitive, and it is necessary to continuously improve product quality and R & D innovation capabilities in order to occupy a place in the market. But overall, with the continuous development of various application fields, the market prospect of 3-chloro-4- (3-fluorobenzoxy) aniline is quite promising and has good development potential.
What are the precautions for 3-chloro-4- (3-fluorobenzyloxy) aniline during storage and transportation?
3-Chloro-4- (3-fluorobenzoxy) aniline is an organic compound. When storing and transporting, all matters need to be treated with caution.
First of all, this compound should be stored in a cool, dry and well-ventilated place. Cover because of its nature or affected by temperature and humidity, if it is placed in a high temperature and humid place, it may cause deterioration. Keep away from fire and heat sources. Open flames and hot topics can cause chemical reactions or be dangerous. It should be stored separately from oxidants, acids, bases, etc. If these numbers meet, it is easy to cause chemical reactions, damage its quality, or even lead to safety accidents. The storage area should be equipped with suitable materials to contain leaks in case of leakage, which can be disposed of in time to avoid greater harm caused by its spread.
As for transportation, it must be handled lightly. This compound may have a certain sensitivity. Rough handling can easily cause package damage and material leakage. Vehicles used for transportation should be clean, dry, and free of residual chemicals to avoid cross-contamination with it. During transportation, it should be exposed to sun and rain. Summer sun and rain can affect its stability. And it should be driven according to the specified route, do not stop in densely populated areas and traffic arteries to prevent leakage from endangering the safety of many people. Transportation vehicles should be equipped with corresponding varieties and quantities of fire equipment and leakage emergency treatment equipment for emergencies.