2 3 Trifluoromethyl Phenyl Amino Pyridine 3 Carboxylate
pyridine pyrrole pyrazine piperidine piperazine

2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylate

    Specifications

    HS Code

    756498

    Chemical Formula C14H10F3N2O2
    Appearance Solid (usually, but depends on conditions)
    Melting Point Specific value would require experimental determination
    Boiling Point Specific value would require experimental determination
    Solubility In Water Low (due to non - polar groups, but specific value needs testing)
    Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform (general prediction)
    Pka Values related to acidic/basic groups need experimental measurement
    Logp Positive value indicating lipophilicity (approximate prediction)
    Crystal Structure Requires X - ray crystallography for determination

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    Frequently Asked Questions

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    What are the chemical properties of 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate?
    2-% {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate, this is an organic compound. Its chemical properties are rich and diverse, let me explain in detail.
    First of all, its physical properties are often crystalline solids, and its stability is quite good due to intermolecular forces. This compound contains a special structure, and the pyridine ring is connected to the trifluoromethylphenyl group, giving it a unique chemical activity. The pyridine ring is basic. Due to the lone pair electrons on the nitrogen atom, it can react with acids to form salts. It can be used as a base catalyst in organic synthesis to promote specific reactions.
    Trifluoromethyl is a strong electron-absorbing group, which will affect the electron cloud distribution of the pyridine ring, reduce the electron cloud density on the pyridine ring, increase the difficulty of electrophilic substitution reaction on the ring, and improve the activity of nucleophilic substitution reaction.
    Its solubility is also worthy of attention. According to the principle of similarity miscibility, because there are both polar group carboxylates, non-polar aromatic rings and trifluoromethyl groups in the molecule, it has good solubility in organic solvents such as dichloromethane, N, N-dimethylformamide, and relatively limited solubility in water.
    In terms of chemical reactivity, the carboxylate moiety can undergo many reactions, such as nucleophilic substitution reaction with active halogenated hydrocarbons to form new ester compounds; the amino moiety can participate in amidation reaction, react with acid chloride, acid anhydride, etc., to form amide derivatives. This property is of great significance in the field of drug synthesis and materials science, and helps to construct complex organic molecular structures and create new functional materials or drug molecules.
    The chemical properties of this compound are determined by its unique molecular structure, which lays the foundation for its application in organic synthesis, pharmaceutical chemistry, materials science and other fields.
    What is the synthesis of 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate?
    To prepare 2 - {[3 - (trifluoromethyl) phenyl] amino} pyridine-3-carboxylic acid ester, the following method can be used.
    First, 3 - (trifluoromethyl) aniline and pyridine-2,3 - dicarboxylic acid anhydride are used as starting materials. 3 - (trifluoromethyl) aniline and pyridine-2,3 - dicarboxylic acid anhydride are placed in a reaction kettle in an appropriate ratio, such as 1:1.2, and an appropriate amount of organic solvent, such as dichloromethane or N, N - dimethylformamide (DMF), is added. Here, the amount of organic solvent is about 5-10 times the total volume of the substrate to facilitate uniform dispersion of the substrate and the progress of the reaction.
    Then, add an appropriate amount of catalyst, such as 4-dimethylaminopyridine (DMAP), in an amount of about 5% - 10% of the total moles of the substrate. Stir the reaction at room temperature or moderate heating, such as 40-60 ° C. This step of the reaction aims to make the amino group of 3- (trifluoromethyl) aniline condensate with one of the carboxyl anhydride groups of pyridine-2,3-dicarboxylic acid anhydride to form an amide intermediate. During the
    reaction, thin layer chromatography (TLC) can be used to monitor, and the reaction will reach the expected level when the raw material point is basically eliminated. After that, the reaction mixture is poured into an appropriate amount of dilute acid solution, such as 1M hydrochloric acid solution, and stirred to dissolve the unreacted raw materials and catalysts and other impurities. At this time, the product 2 - {[3 - (trifluoromethyl) phenyl] amino} pyridine-3 - carboxylic acid precipitates due to its certain hydrophobicity.
    Extract several times with an organic solvent, such as ethyl acetate, and combine the organic phases. The organic phase is then washed with saturated saline to remove water and further remove impurities. Subsequently, the organic phase was dried with anhydrous sodium sulfate, the desiccant was filtered off, and the organic solvent was removed by reduced pressure distillation to obtain the crude product.
    Finally, the crude product was refined by column chromatography, and an appropriate eluent was selected, such as a mixture of petroleum ether and ethyl acetate in a certain proportion. Column chromatography was carried out to separate the fractions containing the pure product. The eluent was removed by rotary distillation to obtain a high-purity 2 - {[3 - (trifluoromethyl) phenyl] amino} pyridine-3 -carboxylic acid ester.
    What are the applications of 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate?
    2-%7B%5B3-%28trifluoromethyl%29phenyl%5Damino%7Dpyridine-3-carboxylate (2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylic acid ester), this compound has applications in medicine, materials science, agricultural chemistry and many other fields.
    In the field of medicine, due to its special chemical structure, it can be combined with specific targets in organisms. With the synergistic effect of trifluoromethyl and pyridine, phenyl and other structures, or can regulate the activity of certain proteins, there is great potential for the treatment of some diseases. For example, by precisely acting on pathogenic protein kinases and blocking abnormal cell signaling pathways, it provides new opportunities for drug development in cancer and inflammatory diseases.
    In the field of materials science, this compound can be used as a key building block for functional materials. Due to its unique electronic properties and chemical stability, its introduction into polymer materials can significantly improve the electrical properties, thermal stability and chemical corrosion resistance of the materials. For example, it is used to prepare new organic semiconductor materials, which are used in optoelectronic devices such as organic Light Emitting Diode (OLED) and organic field effect transistor (OFET) to improve the performance and stability of the devices.
    In the field of agricultural chemistry, it may have certain biological activities. It may exhibit inhibitory or killing effects on certain crop pests and pathogens, providing a direction for the creation of new pesticides. Perhaps it can interfere with the nervous system of pests or destroy the cell wall synthesis of pathogens, thus ensuring the healthy growth of crops, reducing the use of chemical pesticides, and promoting sustainable agricultural development.
    What is the market outlook for 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate?
    There are currently 2 - {[3- (trifluoromethyl) phenyl] amino} pyridine-3 -carboxylic salts, and their market prospects are related to many aspects. This compound may have potential utility in the field of medicine. Looking at the current situation of pharmaceutical research and development, those containing specific functional groups such as trifluoromethyl often exhibit unique activities in the design of drug molecules, which can change the physical and chemical properties of the compound, such as lipophilicity and metabolic stability. This 2 - {[3- (trifluoromethyl) phenyl] amino} pyridine-3 -carboxylate may become a key intermediate for new drugs. Through subsequent chemical modification, molecules with novel pharmacological activities can be constructed to overcome specific diseases. Therefore, there may be opportunities in the innovative drug research and development market.
    In the field of materials science, it may also play a role. Some pyridine and carboxylate derivatives can be used to prepare functional materials, such as optical materials, electronic materials, etc. The structural properties of this compound may endow the material with unique optical and electrical properties, which can be used in optoelectronic devices, sensors, etc. With the development of science and technology, the demand for new functional materials is increasing day by day. If the potential of this compound in the field of materials can be tapped, it will definitely open up a broad market space.
    However, its market prospects are also facing challenges. The complexity of the synthesis process may affect its large-scale production and cost control. If the synthesis route is long and harsh, it will lead to high production costs and disadvantage in market competition. Furthermore, relevant regulations, policies and market access standards are increasingly stringent. To bring this compound to the market, many safety and quality requirements need to be met, which is also an obstacle to the way forward.
    Overall, 2 - {[3 - (trifluoromethyl) phenyl] amino} pyridine - 3 - carboxylate has an addressable market opportunity, but it also needs to overcome the problems of synthesis and regulation in order to emerge in the market and seek development.
    Is the production process of 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate complicated?
    The complexity of the preparation process of Guanfu 2 - {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylate needs to be investigated in detail. The synthesis of this compound involves a multi-step reaction, each step is of critical significance, and if there is a slight error, all previous efforts will be lost.
    The first to bear the brunt, the selection and pretreatment of raw materials are crucial. The purity and properties of the selected raw materials have a profound impact on the subsequent reaction. In order to obtain high-purity products, fine processing of raw materials is indispensable.
    During the reaction process, the control of conditions is like steering a boat, and if there is a little carelessness, it will deviate from the channel. Temperature, pressure, and reaction time all need to be precisely regulated. If the temperature is too high, or the reaction is excessive, many by-products will be produced; if the temperature is too low, the reaction will be slow and inefficient. The regulation of pressure is also related to the rate and direction of the reaction.
    Furthermore, the use of catalysts, such as a clever hand to point gold, can greatly improve the reaction efficiency and selectivity. However, the type and dosage of catalysts need to be tested repeatedly and precisely pinched. Improper catalysts not only do not help the reaction, but also add interference.
    The steps of separation and purification are also not easy. The products are often mixed with unreacted raw materials and by-products, and they need to be removed one by one by suitable methods, such as distillation, extraction, chromatographic separation, etc., to obtain a pure target product.
    Looking at the whole process, the production process of 2- {[3- (trifluoromethyl) phenyl] amino} pyridine-3-carboxylic acid ester is interlocking and complex. Every step requires the attention and exquisite skills of craftsmen to achieve high-quality products.