Chemical Formula | C12H10F2N4O2 |
Molecular Weight | 280.23 |
Appearance | Solid (usually) |
Melting Point | Data may vary depending on purity |
Boiling Point | Data may vary depending on purity |
Solubility In Water | Low (due to non - polar aromatic and triazole groups) |
Solubility In Organic Solvents | Soluble in common organic solvents like dichloromethane, chloroform |
Pka | Related to the carboxylic acid group, data may vary |
Density | Data may vary depending on form |
Stability | Stable under normal conditions, may decompose under extreme heat or strong acids/bases |
Chemical Formula | C12H10F2N4O2 |
Appearance | Solid (usually) |
Melting Point | Data - specific value needed |
Boiling Point | Data - specific value needed |
Solubility In Water | Low (estimated) |
Solubility In Organic Solvents | Moderate in some common solvents like dichloromethane |
Pka | Data - specific value needed |
Density | Data - specific value needed |
Flash Point | Data - specific value needed |
Stability | Stable under normal conditions |
What is the main use of ethyl 1- (2,6-difluorobenzyl) -1H-1,2,3-triazole-4-carboxylate?
1 - (2,6-diethylamino) - 1H - 1,2,3-triazole-4-carboxylic acid ethyl ester, this substance has a wide range of uses.
In the field of medicine, it is a key class of drug intermediates. Because its structure contains specific active groups, it can interact with biological targets and assist in the synthesis of drugs with unique pharmacological activities. For example, in the development of antibacterial drugs, it can be used as a key starting material. After a series of chemical reactions, it can construct drug molecular structures that have inhibitory or killing effects on specific pathogens, providing strong support for the fight against infectious diseases.
In the field of pesticides, it is also an important synthetic component. With its unique chemical structure, pesticides with high insecticidal, bactericidal or herbicidal properties can be synthesized. For example, when designing new insecticides, using their affinity with specific enzymes or receptors in pests, precise synthesis of compounds that can effectively interfere with the physiological metabolism or behavior of pests can achieve high-efficiency, low-toxicity and environmentally friendly pesticide creation, protect crop growth, and ensure food yield and quality.
In materials science, 1- (2,6-diethylamino) -1H-1,2,3-triazole-4-carboxylate ethyl ester also shows application potential. Due to its energetic structure and reactivity, it can be used to prepare specific functional materials. Like in the synthesis of polymer materials with special optical, electrical or thermal properties, it can participate in the polymerization reaction as a functional monomer, endowing the material with unique properties, injecting new vitality into the development of materials science, and promoting technological innovation in related fields.
What are the synthesis methods of ethyl 1- (2,6-difluorobenzyl) -1H-1,2,3-triazole-4-carboxylate?
To prepare 1 - (2,6 - diethylamino) - 1H - 1,2,3 - triazole - 4 - carboxylic acid ethyl ester, there are many methods, and the main one is selected here.
First, the nitrogen-containing heterocyclic compound is used as the starting material. First, the nitrogen heterocyclic ring with suitable substituents and the reagent containing ethylamino group are condensed in an organic solvent under the catalysis of suitable bases. Bases such as potassium carbonate, sodium carbonate, etc., the solvent can be acetonitrile, N, N - dimethylformamide, etc. The reaction temperature needs to be precisely regulated, which varies according to the activity of the raw material, usually between room temperature and 80 degrees Celsius. The intermediate product is obtained by condensation, and then a specific carboxylic acid ester reagent is used to introduce the carboxylic acid ethyl ester group under the action of the catalyst. The catalyst can be selected from organotin or titanate esters. The reaction conditions are mild, the temperature is about 60 to 100 degrees Celsius, and the target product can be obtained after separation and purification.
Second, start from simple monoamines and carboxylic acid derivatives. First, the amine compound is reacted with a suitable halogenated hydrocarbon to introduce ethylamino. Halogenated hydrocarbons such as bromoethane and chloroethane react in an alkaline environment and in the presence of phase transfer catalysts. Basic substances such as sodium hydroxide, potassium hydroxide, and phase transfer catalysts such as tetrabutylammonium bromide. The resulting product is then reacted with a precursor containing a triazole structure, which can be synthesized from raw materials such as cyanamide. The two are cyclized under specific conditions to form a triazole ring, and then a carboxylic acid ethyl ester group is introduced by esterification reaction. The esterification reaction can be catalyzed by concentrated sulfuric acid or p-toluenesulfonic acid with ethanol and corresponding carboxylic acids at a temperature of about 70 to 110 degrees Celsius. After a series of post-treatments such as extraction, distillation, recrystallization, etc., pure 1- (2,6-diethylamino) -1H-1,2,3-triazole-4-carboxylic acid ethyl ester can be obtained.
What are the physical and chemical properties of ethyl 1- (2,6-difluorobenzyl) -1H-1,2,3-triazole-4-carboxylate?
1 - (2,6-diethylamino) -1H - 1,2,3-triazole-4-carboxylate ethyl ester is an organic compound. Its physical and chemical properties are as follows:
Viewed at room temperature, it is mostly white to light yellow crystalline powder with stable properties and is easy to store and operate. The melting point of this substance is in a specific range, which can be accurately measured by means of a melting point tester. The melting point characteristic is crucial in the identification and purification process and can help distinguish the purity.
In terms of solubility, it exhibits good solubility in common organic solvents such as ethanol and dichloromethane. This property is conducive to being used as a reactant or intermediate in organic synthesis reactions, so that the reaction can be carried out efficiently in a homogeneous system, and the reaction rate and yield can be improved. However, the solubility in water is relatively low, which is related to the influence of hydrophobic groups in the molecular structure.
Its chemical properties are active, and the structure of triazole ring and carboxyl ethyl ester in the molecule gives unique reactivity. The triazole ring has electron-rich properties and is easy to react with electrophilic reagents. It can participate in a variety of heterocyclization reactions and expand the diversity of molecular structures. The carboxyl ethyl ester part can be converted into other functional groups by hydrolysis, alcoholysis, aminolysis and other reactions, such as carboxyl groups, alcohol hydroxyl groups, amide groups, etc. It has a wide range of uses in the field of organic synthesis and can be used to prepare drugs, pesticides, functional materials, etc.
In addition, the compound has certain stability and is not easy to decompose or deteriorate spontaneously under normal storage and conventional reaction conditions. In case of extreme conditions such as strong acid, strong base or high temperature, the structure will be affected and corresponding chemical reactions will occur.
In summary, 1- (2,6-diethylamino) -1H-1,2,3-triazole-4-carboxylate ethyl ester is of great significance in organic synthesis and related fields due to its unique physical and chemical properties.
What is the market price of ethyl 1- (2,6-difluorobenzyl) -1H-1,2,3-triazole-4-carboxylate?
I don't know the price of 1- (2,6-diethylamino) -1H-1,2,3-triazole-4-carboxylate ethyl ester as you said in the market. However, if you want to know the price of this product, you should follow various paths.
First, you can visit the cities where chemical raw materials are traded. There are many merchants gathered here, and the price may be available. The prices sold by merchants in the city vary depending on the quality and quantity.
Second, search on the platform where chemical products are traded online. Today's Internet is very convenient, and a lot of chemical information can be obtained here. The prices listed by each supplier may vary by brand, purity, and MOQ.
Third, inquire about the manufacturer of chemical products. Ask the factory directly, or you can get a more accurate and affordable quotation. The factory may also have different price strategies due to your order volume and the possibility of cooperation.
It is a pity that I cannot tell the price directly. You should follow these channels and seek for personal information before you can get the exact price in the market.
What are the storage conditions for ethyl 1- (2,6-difluorobenzyl) -1H-1,2,3-triazole-4-carboxylate?
1 - (2,6 - diethylamino) - 1H - 1,2,3 - triazole - 4 - ethyl carboxylate, this medicine needs to be stored in a cool and dry place, and attention should be paid to moisture-proof and light-proof. Because of its relatively active chemical properties, light and moisture can easily cause chemical reactions and affect the efficacy of the medicine. Storage temperature should be controlled at 10-30 ° C. Too high or too low temperature may change its physical and chemical properties. In addition, it should be stored separately from oxidants, acids, bases, etc. to avoid dangerous reactions caused by mixed storage. When storing, make sure that the package is well sealed to prevent the medicine from deteriorating in contact with air. After taking it, seal it in time and store it strictly according to the above conditions to ensure the quality and stability of the drug, so that it can play its due role during use.