As a leading 5-(2-fluorophenyl)-1H-pyrrole-3-carbaldehyde supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.
What is the chemical structure of 5- (2-fluorophenyl) -1H-pyrrole-3-carbaldehyde?
The chemical structure of 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde should be described according to the understanding of organic chemistry.
This compound contains a pyrrole ring, which is a five-membered nitrogen-containing heterocycle with a conjugated system. It is common in the fields of organic synthesis and pharmaceutical chemistry. 1H-pyrrole indicates that the hydrogen atom is attached to the pyrrole nitrogen atom.
Furthermore, there is a (2-fluorophenyl) group attached to the 5-position. Phenyl is the structural unit of the benzene ring and has aromatic properties. And 2-fluorophenyl, that is, the second position of the benzene ring is connected with a fluorine atom, and the fluorine atom has strong electronegativity, which will affect the electron cloud distribution and physicochemical properties of the molecule.
At the 3-position, there is an aldehyde group (-CHO), which is a highly reactive functional group and can participate in many organic reactions, such as oxidation, reduction, nucleophilic addition and other reactions.
Overall, the chemical structure of 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde is composed of a pyrrole ring as the core, 5-linked 2-fluorophenyl, and 3-linked aldehyde. This unique structure endows the compound with specific chemical activities and physical properties, and has important research and application value in organic synthesis and related fields.
What are the main physical properties of 5- (2-fluorophenyl) -1H-pyrrole-3-carbaldehyde?
5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde, this is an organic compound. Its main physical properties are as follows:
Looking at its properties, it is mostly a solid state under normal conditions, but it also varies depending on the environmental conditions. Its melting point is the temperature at which a substance melts from a solid state to a liquid state. The melting point of this compound is about a specific range, but the exact value needs to be determined by precise experiments. The importance of the melting point is that it can be used to identify the purity of the substance. If the purity is high, the melting point range is narrow and approaching the theoretical value; if it contains impurities, the melting point decreases and the melting range widens.
In terms of boiling point, this is the temperature at which the substance changes from a liquid state to a gas state. Under specific pressure conditions, its boiling point has a specific value, which reflects the strength of intermolecular forces. The boiling point is related to the phase change of the compound at different temperatures, and has an important impact on its storage, transportation and application in chemical reactions.
In terms of solubility, this compound exhibits a certain solubility in organic solvents such as common ethanol and dichloromethane. In polar organic solvents, due to the existence of specific interactions between molecules, such as hydrogen bonds, van der Waals forces, etc., it can mix with solvent molecules. In water, due to its structural characteristics, the solubility is poor, which is mainly due to the large difference between its molecular polarity and that of water molecules, making it difficult to form effective interactions.
In addition, the density of this compound is also an important physical property. Density represents the mass of the substance per unit volume, and specific values can be obtained by accurate measurement. Density is indispensable in the design of material separation, purification and related chemical processes, and can provide key parameters for practical operation.
Its refractive index reflects the degree to which the direction of light changes when it propagates in the substance. The refractive index is closely related to the molecular structure and aggregation state of the substance, and can be used as an effective means to identify the compound and monitor its purity and concentration changes. By accurately measuring the refractive index and comparing it with the standard value, the purity and presence of impurities of the substance can be determined.
In which chemical reactions is 5- (2-fluorophenyl) -1H-pyrrole-3-carbaldehyde commonly used?
5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde is often useful in many reactions in organic synthesis.
First, in nucleophilic addition reactions, due to the activity of aldehyde groups, it can interact with many nucleophilic reagents. Such as with alcohols, under the catalysis of acids or bases, acetalization can occur. In this reaction, the oxygen atom of the alcohol acts as a nucleophilic check point, attacking the carbonyl carbon of the aldehyde group to form hemiacetal, which is then converted into acetal. Acetal has good stability in alkaline environments and is often used to protect the aldehyde group. At the appropriate stage of the reaction, it can be deprotected under acidic conditions to restore the aldehyde group.
Second, in the oxidation reaction, the aldehyde group is easily oxidized. With mild oxidants, such as manganese dioxide, it can be oxidized to the corresponding carboxylic acid. This reaction is crucial in the construction of carboxyl-containing pyrrole derivatives, providing a basis for subsequent derivatization.
Third, in the reduction reaction, reducing agents such as lithium aluminum hydride or sodium borohydride can be used to reduce the aldehyde group to alcohol hydroxyl groups. In this way, the conversion from aldehyde to alcohol is realized, which is common in the synthesis of pyrrole compounds with specific functional groups.
Fourth, in the reaction with amines, nucleophilic addition-elimination reactions can occur to generate imines. Imines can further participate in many reactions, and are an important intermediate for the synthesis of complex pyrrole derivatives, providing an effective way for the construction of nitrogen heterocyclic structures.
In short, 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde has many applications in the field of organic synthesis due to its unique structure and activity, which is beneficial to the preparation of various pyrrole-containing compounds.
What are the methods for preparing 5- (2-fluorophenyl) -1H-pyrrole-3-carbaldehyde?
The preparation method of 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde covers many ways. One method can also be started with fluorobenzene derivatives. First, take a suitable 2-fluorobenzene compound, and introduce a group that can be related to the construction of pyrrole ring under specific reaction conditions. For example, 2-fluorobenzene and pyrrole derivatives with active hydrogen are condensed in an alkali-catalyzed environment. The alkali can be selected from potassium hydroxide, sodium carbonate, etc., in organic solvents such as N, N-dimethylformamide (DMF) or dichloromethane, and the temperature can be controlled. The temperature may be between room temperature and 50 degrees Celsius, depending on the specific reactant activity. At the time of the reaction, carefully observe the reaction process, which can be monitored by thin layer chromatography (TLC). When the raw material point disappears, it is the end point of the reaction. After extraction, column chromatography and other purification steps, a relatively pure product can be obtained.
Furthermore, fluorine atoms can be introduced at the benzene ring check point starting from pyrrole-3-formaldehyde. First, pyrrole-3-formaldehyde is used as a substrate to introduce halogen atoms, such as chlorine atoms, at suitable positions on the benzene ring through a halogenation reaction. The halogenation reagents used, such as N-chlorosuccinimide (NCS), etc., react in inert solvents such as carbon tetrachloride in the presence of light or initiators. Then, a nucleophilic substitution reaction is used to replace the chlorine atoms with fluorine ions. The commonly used fluorine source is potassium fluoride, etc., in polar aprotic solvents such as dimethyl sulfoxide (DMSO), the reaction is heated, the temperature is between 80 and 120 degrees Celsius, and the reaction is completed. After similar separation and purification methods, the target product 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde can also be obtained.
What are the applications of 5- (2-fluorophenyl) -1H-pyrrole-3-carbaldehyde?
5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde is used in various fields such as medicine and materials.
In the field of medicine, it can be used as a key intermediate. Due to its special chemical structure, it can participate in many drug synthesis reactions. For example, when developing small molecule drugs with specific biological activities, using this as the starting material, through multi-step reactions, a structure that fits the biological target can be constructed to achieve precise treatment of diseases. For example, for some cancers, the structure modification of this substance can be used to prepare targeted anti-cancer drugs, so that the drugs can act more precisely on cancer cells, improve the efficacy and reduce the damage to normal cells. < Br >
In the field of materials, it also has unique value. In the synthesis of organic optoelectronic materials, it can be used as an important structural unit. Due to its pyrrole and fluorophenyl-based structure, the material is endowed with unique electrical and optical properties. It can be used to prepare organic Light Emitting Diode (OLED) materials to improve luminous efficiency and stability, making display screens more colorful and longer life. In terms of solar cell materials, its structure helps to optimize charge transport and light absorption performance, improve solar cell photoelectric conversion efficiency, and promote the development of renewable energy. In conclusion, 5- (2-fluorophenyl) -1H-pyrrole-3-formaldehyde has shown broad application prospects in the fields of medicine and materials due to its unique chemical structure, providing an important material basis for the development of related fields.