1h Pyrrole 3 Carbonitrile 4 2 2 Difluoro 1 3 Benzodioxol 4 Yl
pyridine pyrrole pyrazine piperidine piperazine

1H-Pyrrole-3-carbonitrile, 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-

    Specifications

    HS Code

    604681

    Chemical Formula C13H6F2N2O2
    Molecular Weight 260.196 g/mol
    Appearance Solid (likely)
    Physical State At Room Temp Solid
    Solubility In Water Low solubility (due to non - polar aromatic and fluorinated groups)
    Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform

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    Frequently Asked Questions

    As a leading 1H-Pyrrole-3-carbonitrile, 4-(2,2-difluoro-1,3-benzodioxol-4-yl)- supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

    What are the chemical properties of 1H-Pyrrole-3-carbonitrile, 4- (2,2-difluoro-1,3-benzodioxol-4-yl) -
    1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl), the chemical properties of this compound are quite unique. It has certain stability. The structure of benzodioxacyclopentene endows it with certain conjugation stability, which reduces the energy of the molecular system and makes it difficult to react with common weak chemical reagents.
    In the electrophilic substitution reaction, the electron cloud density on the pyrrole ring is high, which is nucleophilic and easy to attract electrophilic reagents to attack. In particular, the methonitrile group at the 3-position of the pyrrole ring is an electron-withdrawing group, but the electron cloud dispersion of the pyrrole ring is high, and the influence of the methonitrile group on its electron cloud distribution is limited, so the electrophilic substitution reaction still occurs easily on the pyrrole ring.
    Under certain basic conditions, due to the electron-withdrawing induction effect of the fluorine atom in the structure of the difluorinated-substituted benzodioxane, the electron cloud in this area is biased towards the fluorine atom, resulting in a partial positive charge of the carbon atom connected to it. When encountering strong basic reagents, nucleophilic substitution reactions are prone to occur. At the same time, the nucleophilic group in the basic reagents can attack this positively charged carbon atom.
    At the same time, the Due to the hydrophobic structure of benzodioxacyclopentene, it has good solubility in common organic solvents such as dichloromethane and chloroform; while the methonitrile group on the pyrrole ring has a certain polarity, and it also has a certain solubility in polar organic solvents such as acetonitrile. This solubility characteristic provides convenience for its chemical synthesis and separation and purification.
    Its physical properties are also related to its chemical properties. The compound is mostly in solid form. Due to the existence of van der Waals force and dipole-dipole interaction between molecules, the molecules are closely arranged and the melting point is relatively high. These characteristics together constitute the unique chemical properties of this compound, which has potential application value in organic synthesis and medicinal chemistry.
    What is the application field of 1H-Pyrrole-3-carbonitrile, 4- (2,2-difluoro-1,3-benzodioxol-4-yl) -
    1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl) This substance has a wide range of uses. In the context of pharmaceutical research and development, it may become a key intermediate, with its unique chemical structure, paving the way for the creation of novel drugs. Because it contains specific functional groups, or has affinity for specific disease-related targets, it provides the possibility of drug exploration to overcome difficult diseases.
    In the field of materials science, it also has potential applications. Because of its structure, it gives unique physical and chemical properties, or can be used to prepare special functional materials. For example, in the field of optoelectronic materials, it can optimize the optical and electrical properties of materials, and contribute to the development of new optoelectronic devices.
    In organic synthetic chemistry, it is an extremely important synthetic building block. Chemists can modify its structure through various chemical reactions, expand the diversity of organic molecules, and then synthesize organic compounds with more complex structures and unique functions, promoting the continuous development of organic synthetic chemistry.
    What are the synthesis methods of 1H-Pyrrole-3-carbonitrile, 4- (2,2-difluoro-1,3-benzodioxol-4-yl) -
    To prepare 1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl), the method is as follows:
    Take the starting material related to 2,2-difluoro-1,3-benzodioxacyclopentene-4-yl first. The raw material needs to be pretreated to remove impurities and purify to ensure excellent purity. Then, in a suitable reaction vessel, an oxygen-free environment is created with an inert gas to prevent oxidative deterioration of the raw material and the intermediate. < Br >
    Add a specific catalyst. The choice of this catalyst is related to the reaction rate and yield, and must be made with caution. At the same time, add a reactant containing pyrrole-3-formonitrile structure, and the ratio of the two is precisely adjusted according to the reaction mechanism and past experience.
    The temperature is controlled in a moderate range. If the temperature is too high or the side reactions occur frequently, if it is too low, the reaction will be delayed. During the reaction, a stirring device is used to fully mix the materials to ensure a uniform reaction. After the reaction is completed, the product is separated and purified to remove impurities, or by column chromatography, or by recrystallization, to obtain pure 1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl) product. When operating, strictly follow the procedures and pay attention to safety to prevent accidents.
    What is the market outlook for 1H-Pyrrole-3-carbonitrile, 4- (2,2-difluoro-1,3-benzodioxol-4-yl) -?
    1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl) This compound has a lot to explore in terms of its current market prospects.
    Today, the field of pharmaceutical research and development is booming, and the development of many innovative drugs has attracted much attention. This compound has a unique structure or has extraordinary uses in drug synthesis. It contains special groups, such as pyrrole and benzodioxacyclopentene, etc. These structures are often key parts of drug activity.
    In the exploration of innovative drugs, researchers are struggling to find novel active ingredients, and this compound may be an ideal choice. Based on it, drugs with excellent efficacy for specific diseases may be developed, such as for some stubborn tumor diseases or neurological diseases.
    Furthermore, the field of materials science should not be underestimated. With the advance of science and technology, the need for materials with special properties is increasing day by day. The unique structure of this compound may endow materials with different electrical and optical properties, making it useful for the preparation of electronic devices and optical materials.
    However, its market prospect is not smooth. The research and development cost is quite high, and many technical problems remain to be solved from laboratory synthesis to large-scale production. And the market competition is fierce, and there are many similar or replaceable compounds. To gain a place in this market, researchers need to make unremitting efforts to reduce costs and improve performance in order to make this compound shine and gain a wide range in the market.
    What are the production processes of 1H-Pyrrole-3-carbonitrile, 4- (2,2-difluoro-1,3-benzodioxol-4-yl) -
    The production process of 1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl) can follow the ancient method and follow the steps of fine handling.
    At the beginning, excellent raw materials need to be prepared. Among them, the preparation of 2,2-difluoro-1,3-benzodioxacyclopentene-4-based related reactants requires specific benzodioxacyclopentene raw materials, in a clean reactor, assisted by a suitable catalyst, fluorine gas is introduced, and the temperature is strictly controlled. During this process, the temperature should be maintained between XX and XX degrees Celsius, and the reaction needs to be patiently stirred under an inert gas protective atmosphere for several hours, so that the fluorine atom precisely replaces the corresponding position of the group to obtain a pure 2,2-difluoro-1,3-benzodioxacyclopentene-4-based raw material.
    Simultaneously, prepare 1H-pyrrole-3-formonitrile-related reactants, take pyrrole as the base, and use a specific reagent in another reaction apparatus. According to a specific reaction path, or addition, or substitution, carefully prepare the reaction conditions, such as the pH of the reaction solution is maintained at about XX, and after a careful reaction operation, a pure 1H-pyrrole-3-formonitrile reactant is obtained.
    Then, combine the above two in a special mixed reaction vessel, add an appropriate amount of co-reactant, and use a clever heating method, or simmer slowly, or heat up in stages to fully react the two. During the reaction process, it is necessary to use keen observation methods, or observe the change of its color, or measure its composition, and adjust the details of the reaction in a timely manner. When the reaction is close to completion, it will go through multiple purification processes, such as filtration, extraction, distillation, etc., to remove its impurities and keep its essence, and finally obtain high-purity 1H-pyrrole-3-formonitrile, 4- (2,2-difluoro-1,3-benzodioxacyclopentene-4-yl) products. The whole production process requires the craftsman to ensure the quality and yield of the product with rigorous heart and exquisite skills.