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What is the chemical structure of 1H-Pyrrole-3-carboxaldehyde, 5- (2-fluorophenyl) -?
1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl), the chemical structure of this compound is like an ancient map containing mysteries, which needs to be scrutinized by the eye of chemistry.
Looking at its name, "1H-pyrrole", this is the basic structure of a five-element nitrogen-containing heterocycle, which is like the cornerstone of an ancient city. In the pyrrole ring, the nitrogen atom occupies a specific position, giving the ring a unique electron cloud distribution and chemical activity.
"3-formaldehyde" indicates that at position 3 of the pyrrole ring, an aldehyde group (-CHO) is connected. The aldehyde group is like a unique logo on the city wall, and is highly reactive. It can participate in many classical reactions, such as nucleophilic addition, which opens up many chemical changes for the whole "city".
And "5- (2-fluorophenyl) " is at position 5 of the pyrrole ring, grafted with a 2-fluorophenyl group. Phenyl is the representative of the aromatic family, with a conjugated stable structure, like a sturdy castle in the city, giving the compound a certain stability and hydrophobicity. The fluorine atom is substituted at the No. 2 position of the phenyl group, and the electronegativity of fluorine is very strong. It is like a special powerhouse in a pavilion, which significantly affects the electron cloud density of the phenyl group, and then changes the physical and chemical properties and reactivity of the whole molecule.
In this way, the various parts are interconnected and influenced each other, and together they build the unique chemical structure of 1H-pyrrole-3-formaldehyde and 5- (2-fluorophenyl). It is like a carefully constructed ancient city, which contains countless mysteries of chemical changes.
What are the physical properties of 1H-Pyrrole-3-carboxaldehyde, 5- (2-fluorophenyl)?
1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl), this substance has the following physical properties:
Its appearance is usually a solid of a specific form, and under normal conditions, the color may be white to off-white, and it has a certain crystalline form. The shape and size of the crystal may vary according to the preparation method and conditions. The determination of its melting point is quite critical. The melting point of this substance has been accurately measured to be within a certain temperature range. This temperature range is one of the important indicators to determine its purity and characteristics.
Furthermore, solubility is also an important physical property. In the environment of organic solvents, such as common ethanol, dichloromethane, acetone, etc., this substance exhibits different degrees of solubility. In ethanol, under certain temperature and concentration conditions, it can be partially dissolved to form a homogeneous or slightly cloudy dispersion system; in dichloromethane, it has better solubility and can dissolve quickly to form a clear and transparent solution. This property is conducive to its operation and application in organic synthesis reactions. In water, the solubility of this substance is extremely low, and it is difficult to dissolve in aqueous phase systems with strong polarity due to the large proportion of hydrophobic parts in its molecular structure. The value of its density also reflects specific physical properties. Although the exact density needs to be measured by professional instruments, it can be roughly known that it is in a certain relative range compared with the density of common organic solvents and water. This density characteristic has a significant impact on the separation, extraction and other operations. In addition, the volatility of this substance is weak, and it rarely evaporates to the gas phase at room temperature and pressure, which contributes to the stability of its storage and operation.
1H-Pyrrole-3-carboxaldehyde, 5- (2-fluorophenyl) - is common in which chemical reactions
1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl) This substance is commonly found in a variety of organic synthesis reactions. In arylation reactions, it can be used as a key substrate to construct novel fluoroaryl-containing pyrrole derivatives with halogenated aromatics under the action of specific metal catalysts and ligands through the carbon-carbon bond formation mechanism. Such derivatives may have potential applications in the field of medicinal chemistry, such as as precursor compounds for new anti-tumor and antiviral drugs.
In nucleophilic addition reactions, the aldehyde group of this substance exhibits high reactivity and can react with various nucleophilic reagents, such as alcohols and amines. When reacted with alcohol, acetal products can be formed, which is often used as a carbonyl protection method in organic synthesis to protect the aldehyde group from unnecessary reactions during the construction of complex molecules, and then deprotect and restore the activity of the aldehyde group at an appropriate stage. The reaction with amines produces imines, which are important intermediates in many subsequent reactions and can be further converted into various nitrogen-containing compounds.
In the cyclization reaction system, 1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl) can participate in the process of intramolecular cyclization, forming a complex and unique heterocyclic system. By rationally designing the reaction conditions and reactant structure, the cyclic check point and product structure can be precisely regulated, which is of great significance for the synthesis of heterocyclic compounds with specific physiological activities or material properties. For example, in the synthesis of new photoelectric materials, the formed special heterocyclic structure or endow the material with unique optical and electrical properties.
What are the synthesis methods of 1H-Pyrrole-3-carboxaldehyde, 5- (2-fluorophenyl) -
The synthesis of 1H-pyrrole-3-formaldehyde and 5- (2-fluorophenyl) is a key research direction in the field of organic chemistry. To obtain this compound, several common methods can be followed.
First, a pyrrole ring is established by a multi-step reaction with a starting material containing 2-fluorophenyl, and then an aldehyde group is introduced at the 3 position of the pyrrole ring. For example, a suitable halogenated aromatic hydrocarbon is selected to undergo nucleophilic substitution with a pyrrole precursor to form an intermediate linking fluorophenyl to pyrrole. Then, by suitable oxidation or other functional group conversion means, an aldehyde group is generated at the 3 position of pyrrole.
Second, the skeleton of pyrrole-3-formaldehyde can also be constructed first, and then 2-fluorophenyl can be introduced at the 5th position. In this case, pyrrole can be condensed with specific aldose to generate pyrrole-3-formaldehyde derivatives. Subsequently, 2-fluorophenyl can be introduced at the 5th position by halogenation or other nucleophilic substitution reactions.
During the reaction process, many factors need to be carefully considered. Such as the purity of the reaction reagent, reaction temperature, reaction time, and the choice of solvent, all have a great influence on the reaction process and product yield. A suitable reaction temperature can effectively promote the reaction. Too high or too low may cause side reactions to increase or slow down the reaction rate. Suitable solvents can not only help the reactants dissolve, but also affect the selectivity of the reaction.
In addition, the separation and purification steps after the reaction cannot be ignored. Column chromatography, recrystallization, etc. can often be used to obtain high-purity 1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl) products. Through this series of operations, the synthesis of the target compound can be achieved more efficiently.
1H-Pyrrole-3-carboxaldehyde, 5- (2-fluorophenyl) - is mainly used in what fields
1H-pyrrole-3-formaldehyde, 5- (2-fluorophenyl) This substance has its uses in the fields of medicine, materials, etc.
In the field of medicine, or involved in drug creation. Its structural properties make it possible to act as a key intermediate for the construction of compounds with specific pharmacological activities. Or to have affinity for specific disease targets, by modifying and modifying this structure, it may be possible to develop new therapeutic drugs, such as anti-tumor and anti-viral genera.
In the field of materials, or related to organic optoelectronic materials. The structure of fluorophenyl and pyrrolialdehyde may endow materials with unique optical and electrical properties. Or it can be used to prepare organic Light Emitting Diode (OLED) materials, with its structural advantages, to optimize the material's luminous efficiency, stability and other properties; or it can be used in solar cell materials to improve the photoelectric conversion efficiency.
Furthermore, in the field of chemical synthesis research, this compound may be an important cornerstone. Chemists can use it to carry out various reactions, explore novel synthesis paths, expand the boundaries of organic synthesis chemistry, and pave the way for the preparation of more complex and high-value compounds. In fact, it is a substance with potential value and research significance in many fields.