1 4 Fluorobenzyl Urea
Fluorine Difluoride Fluorobenzene Fluorobenzyl Trifluorotoluene
1-(4-fluorobenzyl)urea
Chemical Formula C8H9FN2O
Molar Mass 168.17 g/mol
Appearance White to off - white solid
Melting Point 185 - 188 °C
Solubility In Water Low solubility in water
Solubility In Organic Solvents Soluble in some organic solvents like DMSO, chloroform
Vapor Pressure Very low vapor pressure at room temperature
Chemical Formula C8H9FN2O
Molar Mass 168.17 g/mol
Appearance Solid
Melting Point 150 - 152 °C
Solubility In Water Low
Solubility In Organic Solvents Moderate in some organic solvents like ethanol, chloroform
Vapor Pressure Low
Pka N/A (no acidic or basic functional groups with easily measured pKa in common conditions)
Stability Stable under normal conditions
FAQ

What are the chemical properties of 1- (4-fluorobenzyl) urea?

1 - (4 - fluorobenzyl) urea, its chemical properties are as follows:

In this compound, the urea group (-NHCONH-) is the key structural part, giving it a certain reactivity. From the perspective of physical properties, it is usually a white crystalline powder with a certain melting point. This is due to the interaction of hydrogen bonds between molecules, which makes the molecules arranged in an orderly manner, and the lattice disintegrates and melts at a specific temperature.

In terms of chemical activity, the nitrogen atom in the urea group has a lone pair of electrons, which can participate in the reaction as a nucleophilic reagent. For example, it can undergo a nucleophilic substitution reaction with halogenated hydrocarbons. The nitrogen atom attacks the carbon atom of the halogenated hydrocarbon, and the halogen atom leaves to form a new nitrogen-containing derivative. At the same time, carbonyl (C = O) is also reactive, and can undergo addition reactions with some nucleophiles such as alcohols and amines. Under acidic or basic conditions, urea groups may undergo hydrolysis. In acidic media, protons first combine with carbonyl oxygen to enhance the positive electricity of carbonyl carbons, and water molecules attack carbonyl carbons, and then gradually hydrolyze to generate corresponding amines, carbon dioxide and ammonia; under basic conditions, hydroxide ions attack carbonyl carbons, which also triggers the hydrolysis process.

In addition, although fluorine atoms on benzene rings are highly electronegative, due to their special electronic effects, they will affect the electron cloud density distribution of benzene rings in some reactions, resulting in selective changes in the substitution reaction region on benzene rings. For example, during the electrophilic substitution reaction, the electron cloud density of the adjacent and para-position of the fluorine atom is relatively high, and the electrophilic reagent is more inclined to attack these positions.

In terms of solubility, due to the polar urea group in the molecule, it has a certain solubility in some polar solvents such as ethanol and dimethyl sulfoxide, but the overall polarity is not very high, and the solubility in water is relatively limited.

What are the main uses of 1- (4-fluorobenzyl) urea?

1- (4-fluorobenzyl) urea has a wide range of uses. In the field of medicine, this substance is often a key raw material for the creation of new drugs. Due to its unique chemical structure, it can interact with specific targets in the body, or has various pharmacological activities such as antibacterial, antiviral, and antitumor. For example, when developing antibacterial drugs for specific bacteria, 1- (4-fluorobenzyl) urea can be cleverly modified to precisely act on the key metabolic pathways of pathogens, thereby inhibiting the growth and reproduction of pathogens.

In terms of pesticides, 1- (4-fluorobenzyl) urea also has important functions. It can produce high-efficiency and low-toxicity insecticides, and its mechanism of action may interfere with the normal growth and development of pests. For example, it affects the pests' molting process, so that the pests cannot successfully complete the growth stage, and finally achieve the purpose of controlling the population of pests. Compared with traditional highly toxic pesticides, these pesticides are less harmful to the environment and non-target organisms, and meet the needs of current green agriculture development.

In the field of materials science, 1- (4-fluorobenzyl) urea can participate in the preparation of materials with special properties. Because it contains specific functional groups, it can react with other compounds through polymerization to generate materials with unique physical and chemical properties. For example, it can be used to prepare materials with selective adsorption or separation functions for specific substances, which are very useful in the separation and purification process of chemical production; or it can enhance the stability and heat resistance of materials and expand the application range of materials.

In addition, in organic synthetic chemistry, 1- (4-fluorobenzyl) urea is often used as an important intermediate. Chemists can derive organic compounds with diverse structures by performing a series of chemical reactions on it, providing rich raw materials and possibilities for the development of organic synthetic chemistry, and promoting the creation and research of new organic compounds.

What is the synthesis method of 1- (4-fluorobenzyl) urea?

To prepare 1 - (4 -fluorobenzyl) urea, you can do it according to the following method.

Take 4-fluorobenzyl amine as the starting material. Dissolve it in an appropriate amount of organic solvents, such as alcohols, such as ethanol, or halogenated hydrocarbons, such as dichloromethane, to form a uniform solution.

Another urea is also soluble in a suitable solvent, such as hot water, or some polar organic solvents. The solution of urea is slowly poured into the solution of 4-fluorobenzyl amine with gentle stirring. < Br >
Due to the reaction or specific conditions are required to promote it, it can be heated to an appropriate temperature, such as 40 ° C - 60 ° C, maintained at this temperature and stirred continuously, so that the two can fully react. During the reaction, nucleophilic substitution occurs between molecules, and the amino group of urea is combined with the benzyl part of 4-fluorobenzyl amine to gradually produce 1- (4-fluorobenzyl) urea.

After the reaction is completed, the product can be separated and purified according to the characteristics of the product. If the product is solid, the product can be crystallized and precipitated by cooling the solution, and then the solid crude product can be obtained by filtration. After recrystallization with an appropriate solvent, such as ethanol-water mixed solvent, to remove impurities to obtain pure 1- (4-fluorobenzyl) urea. If the product is a liquid, distillation can be used to separate the pure product according to the boiling point of the product and the impurity.

Or it can be reacted with urea by 4-fluorobenzyl chloride. Place 4-fluorobenzyl chloride and urea in a suitable reaction vessel, add a base as an acid binding agent, such as potassium carbonate, and then dissolve it with an organic solvent. At a certain temperature, the base is combined with the generated acid to promote the reaction forward. Subsequent separation and purification steps are also carried out to obtain the target product 1- (4-fluorobenzyl) urea.

What should be paid attention to when storing and transporting 1- (4-fluorobenzyl) urea?

For 1 - (4 -fluorobenzyl) urea, many matters need to be paid attention to when storing and transporting.

First, store, this substance should be placed in a cool and dry place. Because of the cool environment, it can reduce the risk of chemical changes caused by excessive temperature; dry place, it can avoid moisture hydrolysis. If it is in a humid and warm place, or cause it to deteriorate, it will damage its quality and utility. And it should be stored in a well-ventilated place to prevent the accumulation of harmful gases, affect the stability of the substance, and ensure the safety of the storage environment.

Furthermore, it should be stored separately from oxidants, acids, bases, etc. This is determined by its chemical properties. 1- (4-fluorobenzyl) urea and the above substances may easily react chemically, causing hazards such as combustion, explosion, etc. Therefore, classified storage is extremely critical.

As for transportation, be sure to ensure that the packaging is complete and well sealed. A complete package can avoid its leakage, and a seal can prevent external factors from interfering. During transportation, it is also necessary to protect against sun exposure and rain, which will affect its chemical stability. And the means of transportation must be clean and hygienic, without other contaminants remaining, so as not to mix impurities and affect the purity and performance of 1- (4-fluorobenzyl) urea.

In addition, transport personnel should be familiar with the characteristics of the substance and emergency treatment methods. In case of leakage and other emergencies, it can be dealt with in time and properly to minimize the harm. In this way, when storing and transporting 1- (4-fluorobenzyl) urea, caution should be taken to ensure its safety and quality.

What are the effects of 1- (4-fluorobenzyl) urea on the environment and humans?

1 - (4 - fluorobenzyl) urea, its impact on the environment and human body is a matter of concern today.

This substance may have various effects in the environment. It may enter the soil, causing soil ecological changes. Soil microbial communities tend to exist in a delicate balance, and the entry of 1 - (4 - fluorobenzyl) urea may disturb its metabolism and reproduction. Microorganisms, in the soil material cycle, nutrient transformation to heavy, if it is disturbed, the soil fertility and structure can change.

And it may enter the water body, causing harm to the aquatic ecosystem. Phytoplankton, algae, etc. in the water are the beginning of the biological chain, and 1- (4-fluorobenzyl) urea may harm its growth and physiological function. And it may accumulate through the food chain, causing high-end aquatic organisms to also suffer from it, damaging the integrity and stability of aquatic ecology.

As for the human body, it should not be ignored. If people are exposed to this 1- (4-fluorobenzyl) urea through breathing, diet, skin contact, etc., it may be harmful to health. In physiological functions, or disturb the endocrine system, causing hormone imbalance. Hormones are the key to human regulation, and imbalances can cause circadian rhythm disorder, various diseases or health.

Furthermore, it may have potential carcinogenicity and mutagenicity. Although the evidence is incomplete, it is inferred from the nature of chemicals that its genetic material in human cells may have the risk of mutagenesis, causing abnormal cell proliferation and differentiation, and gradually becoming cancerous.

From this perspective, 1- (4-fluorobenzyl) urea is potentially dangerous in the environment and the human body. It should be studied in detail to ensure ecological safety and human health.