Chemical Formula | C10H12F3N2O3 |
Molecular Weight | 266.21 |
Chemical Formula | C10H12F3N2O3 |
Molecular Weight | 266.21 |
Appearance | Solid (usually) |
Melting Point | Data needed |
Boiling Point | Data needed |
Solubility In Water | Limited solubility (estimate) |
Solubility In Organic Solvents | Soluble in some organic solvents like DMSO (estimate) |
Pka | Data needed |
Density | Data needed |
Stability | Stable under normal conditions (estimate) |
Chemical Formula | C10H12F3N2O3 |
Molecular Weight | 266.21 |
Appearance | Solid (usually white or off - white powder) |
Physical State At Room Temperature | Solid |
Melting Point | N/A (specific value needs experimental determination) |
Boiling Point | N/A (specific value needs experimental determination) |
Solubility In Water | Low solubility (expected, due to its hydrophobic groups) |
Solubility In Organic Solvents | Soluble in some organic solvents like dichloromethane, chloroform (expected behavior) |
Pka Value | N/A (specific value needs experimental determination, related to its acidic carboxyl group) |
Flash Point | N/A (specific value needs experimental determination) |
Chemical Formula | C10H12F3N2O3 |
Molar Mass | 266.21 g/mol |
Appearance | Solid (usually white or off - white) |
Melting Point | N/A (specific value needs experimental determination) |
Boiling Point | N/A (specific value needs experimental determination) |
Solubility In Water | Low (due to non - polar fluorinated and alkyl groups) |
Solubility In Organic Solvents | Soluble in common organic solvents like dichloromethane, chloroform |
Pka | N/A (specific value needs experimental determination) |
Density | N/A (specific value needs experimental determination) |
Stability | Stable under normal conditions, but may react with strong oxidizing or reducing agents |
What are the chemical properties of 3- (3,3,3-trifluoro-2,2-dimethylpropoxy) -1H-pyrazole-4-carboxylic acid
3- (3,3,3-trifluoro-2,2-dimethylcarbamoyl) -1H-indole-4-carboxylic acid, which has unique chemical properties. In its structure, trifluoromethyl, dimethylcarbamoyl, indole ring, carboxyl and other groups endow it with diverse characteristics.
From the perspective of physical properties, due to the presence of polar carboxyl groups, it will have certain solubility in polar solvents (such as water and alcohols), and the existence of trifluoromethyl will affect its melting point, boiling point, etc. Trifluoromethyl has strong electron absorption, which changes the polarity of molecules and affects its solubility and phase behavior in different solvents.
Chemically, carboxyl groups are acidic and can neutralize with bases to form corresponding carboxylate. For example, the reaction with sodium hydroxide can generate the corresponding sodium salt, which is used for the conversion and modification of carboxyl groups in organic synthesis. At the same time, the indole ring is an electron-rich aromatic ring, which is prone to electrophilic substitution reactions. For example, under appropriate conditions, it can react with electrophilic reagents such as halogenated hydrocarbons, and introduce substituents at specific positions of the indole ring, laying the foundation for the synthesis of complex indole derivatives.
Dimethylaminocarboxyloxy moiety, in which the amino group has a certain nucleophilicity, can participate in nucleophilic substitution or addition reactions under appropriate conditions, and react with halogenated hydrocarbons or carbonyl compounds to realize the modification and derivatization of the structure of this part, providing various possibilities for organic synthesis, and has potential application value in pharmaceutical chemistry, materials science and other fields.
What are the preparation methods of 3- (3,3,3-trifluoro-2,2-dimethylpropoxy) -1H-pyrazole-4-carboxylic acid
To prepare 3- (3,3,3-trifluoro-2,2-dimethylethoxycarbonyl) -1H-indole-4-carboxylic acid, there are various methods.
First, it can be obtained from the corresponding indole derivative through a specific substitution reaction. First, take a suitable indole parent, in a suitable solvent, under the action of a specific catalyst, meet with the reagent containing 3,3,3-trifluoro-2,2-dimethylethoxycarbonyl, control the temperature and duration, so that the substitution reaction can occur smoothly, then introduce this specific group at the 3rd position of indole. Thereafter, through clever transformation, the carboxyl group is introduced at the 4th position. Or first modify the indole 4 position, introduce a group that can be converted into a carboxyl group, and then perform the transformation. After hydrolysis, oxidation and other steps, the final target is 3- (3,3,3-trifluoro-2,2-dimethylethoxycarbonyl) -1H-indole-4-carboxylic acid.
Second, to construct the indole ring. Select suitable starting materials, such as nitrogen-containing and carbon-containing compounds, to form indole rings by cyclization. In the reaction process, 3,3,3-trifluoro-2,2-dimethylethoxy carbonyl and 4-carboxyl related structural units are introduced simultaneously or step by step. Many classical reactions in organic synthesis, such as nucleophilic substitution, electrophilic substitution, condensation reaction, etc., can be used to skillfully splice each part, and through multi-step reactions, the construction of the target molecule is gradually achieved. This process requires fine regulation of the reaction conditions at each step to ensure that the reaction proceeds in the expected direction and obtains a pure product.
Third, it may be possible to learn from the synthesis paths of existing similar compounds and skillfully modify and adjust according to the structural differences of the target. Refer to the experience of synthesis of similar indole compounds, flexibly change the reaction steps and reagents to adapt to the synthesis requirements of 3- (3,3,3-trifluoro-2,2-dimethylethoxycarbonyl) -1H-indole-4-carboxylic acid. However, no matter what method, it is necessary to have a deep understanding of organic chemistry, be proficient in experimental operations, and carefully observe the details of the reaction to obtain this compound.
In which fields is 3- (3,3,3-trifluoro-2,2-dimethylpropoxy) -1H-pyrazole-4-carboxylic acid used?
3- (3,3,3-trifluoro-2,2-dimethylethoxycarbonyl) -1H-pyrazole-4-carboxylic acid, which has important applications in medicine, pesticides, material science and other fields, is a compound that cannot be ignored.
In the field of medicine, as a key intermediate, it can be used to synthesize drug molecules with unique biological activities. With its special chemical structure, it can precisely bind to specific biological targets and exhibit significant pharmacological effects. For example, in the process of anti-tumor drug development, new compounds constructed on this basis may effectively inhibit the proliferation of tumor cells, and are expected to reduce the toxic and side effects on normal cells, opening up a new path for cancer treatment. < Br >
In the field of pesticides, it can be used to create high-efficiency, low-toxicity and environmentally friendly pesticide products. Due to its unique chemical properties, the compound may interfere with specific physiological processes of pests, thus achieving excellent insecticidal and insect repellent effects. At the same time, it has good degradability in the environment and has little impact on the ecological environment, which is in line with the current development needs of green agriculture.
In the field of materials science, this compound can serve as a key component in the construction of functional materials. After rational design and modification, it may endow materials with special properties such as fluorescence, electrical conductivity, and thermal stability. For example, it can be introduced into polymer materials, or luminescent materials with special optical properties can be prepared, which have potential application value in display technology and other aspects.
What is the market prospect of 3- (3,3,3-trifluoro-2,2-dimethylpropoxy) -1H-pyrazole-4-carboxylic acid?
3- (3,3,3-trifluoro-2,2-dimethylethoxy) -1H-indole-4-carboxylic acid, which has considerable market prospects.
Looking at its characteristics, the unique trifluoromethyl and dimethylethoxy groups in its structure give it special physical and chemical properties. Trifluoromethyl can enhance the lipophilicity of molecules and improve their solubility in organic solvents, which is crucial in the field of drug development to improve the cell membrane penetration ability of drugs. Dimethoxy may affect the stability and steric resistance of molecules, and can be used to regulate the microstructure and properties of materials in the field of materials science. < Br >
In terms of the drug market, due to its unique structure, it may become a key intermediate for the development of new drugs. Taking the treatment of specific diseases as an example, if the disease target has high affinity with molecules with such structural characteristics, then the drugs developed on this basis may exhibit high activity and selectivity, which is expected to solve the problems of poor efficacy or high side effects of existing drugs, and the market potential is huge.
In the field of materials, it can be used as a building block for functional materials. For example, it can be used to prepare new liquid crystal materials, whose special structure can regulate the stability and response speed of the liquid crystal phase to meet the needs of display technology for high-performance liquid crystal materials; or it can be used to prepare high-performance coatings to enhance the chemical corrosion resistance and wear resistance of coatings. There is a broad application space in high-end equipment manufacturing and other fields.
With the development of science and technology and the growth of demand in various industries, the exploration of compounds with special structures and properties continues to deepen. 3- (3,3,3-trifluoro-2,2-dimethylethoxy) -1H-indole-4-carboxylic acid will usher in more development opportunities in many fields such as drugs and materials with its unique structure, and the market prospect is quite bright.
What are the upstream and downstream products of 3- (3,3,3-trifluoro-2,2-dimethylpropoxy) -1H-pyrazole-4-carboxylic acid?
3- (3,3,3-tricyanogen-2,2-dimethylaminoformyl) -1H-pyrazole-4-carboxylic acid, this product is very special, and there are many upstream and downstream products, each of which has a wonderful use.
The upstream product prepares this compound, and the selection of raw materials is the key. To prepare 3- (3,3,3-tricyanogen-2,2-dimethylaminoformyl) -1H-pyrazole-4-carboxylic acid, specific pyrazole derivatives are often used as starting materials. First take a suitable pyrazole and introduce a specific substituent at a specific position. This involves fine organic synthesis steps, or nucleophilic substitution, condensation and other reactions. For example, halogenated pyrazoles containing appropriate substituents and reagents containing cyano- and iminoformyl groups, under suitable catalysts and reaction conditions, through nucleophilic substitution, the cyano- and iminoformyl groups are connected to the pyrazole ring, which lays the foundation for subsequent synthesis. Or prepare pyrazolones containing specific substituents first, and gradually construct the target molecular structure through a series of reactions such as rearrangement and substitution.
Downstream products are also widely used and have important uses. 3- (3,3,3 -tricyano- 2,2 -dimethylaminoformyl) -1H -pyrazole-4 -carboxylic acids can be esterified and reacted with alcohols under acid catalysis to generate corresponding ester derivatives. Such esters can be used as intermediates in organic synthesis and participate in further reactions, such as reacting with Grignard reagents to construct more complex organic molecular structures, which may have important applications in the field of drug synthesis. Furthermore, it can react with amines to form amide derivatives. Amide compounds have great potential in material science and bioactive molecular research, or can be used to prepare polymer materials with special properties, or as potential drug lead compounds, through structural modification and optimization, to develop new drugs. At the same time, by reducing its carboxyl group, corresponding alcohols can be obtained. Such alcohols are also important intermediates in organic synthesis, which can participate in various reactions such as oxidation and substitution, expand the structural diversity of compounds, and provide possibilities for applications in more fields.