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What is the chemical structure of 6-methyl-3-pyridinecarboxamide?
6-Methyl-3-pyridinecarboxamide, the Chinese name is 6-methyl-amide. In the formula, the core is pyridine. Pyridine is a hexadecyl group composed of five carbon atoms and one nitrogen atom, which is aromatic. In the third position of pyridine, a formamide group (-CONH _ 2) is connected. In this group, the carbon atom is an oxygen atom, and the nitrogen atom forms an amide. In the sixth position of pyridine, that is, the position of the nitrogen atom, is connected to a methyl group (-CH).
The whole molecule is connected to each other, forming a specific empty pattern. The pyridine in this molecule has certain aromaticity and anti-activity, and the formamide group makes the molecule have certain anti-activity. The presence of methyl groups affects the anti-activity, fat solubility, and space resistance of the molecule. Some of them jointly determine the physicalization of 6-methyl-3-pyridinecarboxamide and its properties in anti-activity and biological activity.
What are the main physical properties of 6-methyl-3-pyridinecarboxamide?
6-Methyl-3-pyridineformamide, its shape is mostly white to off-white crystalline powder. It has a certain melting point, about 175-178 ° C. At this temperature, the solid phase will convert to the liquid phase. This property can be used for purity identification. The melting point of the pure product is relatively fixed. If it contains impurities, the melting point will be reduced and the melting range will be wider.
Its solubility is also an important physical property. The degree of solubility in water is limited. Because the molecule contains hydrophobic methyl and pyridine rings, only the amide group can form hydrogen bonds with water, so it is slightly soluble in water. However, it has different performance in organic solvents, such as easily soluble in halogenated hydrocarbons such as dichloromethane and chloroform. Due to the existence of van der Waals force between halogenated hydrocarbons and molecules, and the similar polarity is conducive to mutual solubility; in alcoholic solvents such as methanol and ethanol, it also has good solubility. The alcohol hydroxyl group can form hydrogen bonds with the amide group to improve solubility.
The substance is also stable. Under normal conditions, it can exist stably in a dry and cool environment, and the pyridine ring and the amide group in the chemical structure are relatively stable, and it is not easy to spontaneously decompose. However, in the case of strong acids and bases, the amide group may hydrolyze, generating 6-methyl-3-pyridinecarboxylic acid and ammonia (or ammonium salt) under acid catalysis; 6-methyl-3-pyridinecarboxylate and ammonia under base catalysis. In addition, extreme conditions such as high temperature and light may also affect its stability, promote molecular structure changes, and affect its quality and performance.
6-methyl-3-pyridinecarboxamide in what areas
6-Methyl-3-pyridineformamide is useful in the fields of medicine and chemical industry.
In the field of medicine, it can be a key raw material for the creation of new drugs. Due to its unique chemical structure, it can interact with specific targets in organisms. For example, it may be able to precisely bind certain protein receptors to regulate physiological functions in the body. In the development of anti-cancer drugs, it may inhibit the proliferation and spread of cancer cells, providing a new way to overcome cancer problems; in the development of drugs for the treatment of nervous system diseases, it may regulate the release and transmission of neurotransmitters, helping to relieve related symptoms and improve the quality of life of patients.
In the chemical field, this substance also has important value. First, it can be used as an excellent organic synthesis intermediate. Based on it, chemists can construct complex and diverse organic compounds through exquisite reaction design. These compounds are widely used in material science, such as the preparation of high-performance polymer materials, which can improve the strength, toughness and stability of materials. They are used in aerospace, automobile manufacturing and other industries that require strict material properties. In the dye industry, new dyes with bright colors, light resistance and washable properties can be developed to meet the needs of textile printing and dyeing industries.
Furthermore, in the creation of agricultural chemicals, 6-methyl-3-pyridineformamide can also be used. It may be able to participate in the synthesis of highly efficient and low-toxicity pesticides, which are highly destructive to pests, but have little impact on the environment and non-target organisms. This is in line with the current concept of green agriculture development, helping to ensure crop yield and quality, and maintaining the sustainable development of agriculture.
What are 6-methyl-3-pyridinecarboxamide synthesis methods?
The synthesis method of 6-methyl-3-pyridineformamide has been investigated by many parties throughout the ages, and there are many ways.
One is to use the corresponding pyridine derivative as the starting material. For example, 6-methyl-3-pyridineformic acid can be selected as the substrate to react with a suitable amination agent. In this process, the reaction is often assisted by a condensing agent. Common condensing agents such as dicyclohexyl carbodiimide (DCC) can promote the condensation of carboxyl groups and amino groups to form amide bonds. The reaction is usually carried out in organic solvents, such as dichloromethane, N, N-dimethylformamide (DMF), etc. Such solvents can effectively dissolve the reactants and make the reaction occur smoothly. The reaction conditions are mild, and the temperature is generally controlled at room temperature to a moderate heating range. The reaction process needs to be closely monitored. The consumption of raw materials and the generation of products are tracked by means of thin layer chromatography (TLC) to ensure that the reaction achieves the desired effect.
Second, from the perspective of the construction of nitrogen-containing heterocycles. The pyridine ring can be constructed through a multi-step reaction, and methyl and carboxyl groups are introduced at the same time, followed by amidation. For example, using a suitable nitrogenous compound and an unsaturated carbonyl compound, a cyclization reaction occurs under the catalysis of a base to form a pyridine ring skeleton. After that, a specific position on the ring is modified to introduce methyl groups, and then the carboxyl group is converted into an amide group. Although this route is a bit complicated, it can precisely control the position and structure of the substituent, providing an effective way for the synthesis of the target product. The reaction conditions at each step in the process need to be carefully regulated, including the ratio of reactants, reaction temperature, reaction time, and the choice of catalyst. A slight difference in the pool may affect the yield and purity of the final product.
Furthermore, biosynthetic methods can also be used. The synthesis of 6-methyl-3-pyridineformamide is achieved by the catalytic action of specific microorganisms or enzymes. Some enzymes in microorganisms can catalyze the conversion of specific precursors, which has the advantages of high selectivity and environmental friendliness. However, this method is demanding on the reaction system, requiring precise control of microbial growth environment, enzyme activity and stability, and the biosynthetic process is relatively complex and difficult to study. However, with the development of biotechnology, its potential cannot be underestimated.
How safe is 6-methyl-3-pyridinecarboxamide?
6-Methyl-3-pyridineformamide is also a common compound in the chemical and pharmaceutical fields. In terms of its safety, it needs to be examined from multiple angles.
First, toxicity, after many experimental investigations, rats have a high oral half lethal dose (LD50), which shows that its acute toxicity is relatively low. However, toxicity is not only related to the acute end, long-term or repeated exposure must also be considered. Suppose people often come into contact with it, or cause skin and eye irritation. If the skin touches it, it may feel itchy, red and swollen; if the eyes encounter it, it may feel tingling, tearing, and there is a risk of damage to eye tissue.
Let's talk about the environmental impact again. If this substance enters the environment, it may be harmful to aquatic organisms. After research, it can have adverse effects on the growth and reproduction of aquatic organisms such as fish and algae. And its degradation rate in the environment is slow, and it can remain in water and soil, which will affect the balance of the ecosystem.
Re-discussion on the risk of explosion, 6-methyl-3-pyridineformamide is a flammable substance, which is dangerous to burn in case of open flames and hot topics. And when burning or releasing toxic nitrogen oxide gas, it is threatening to human body and the environment.
On storage and transportation, when storing, it should be placed in a cool and ventilated place, away from fire and heat sources to prevent accidents. When transporting, it must also follow the regulations of relevant hazardous chemicals to ensure safety.
In summary, although 6-methyl-3-pyridineformamide has low acute toxicity, it must be used, stored and transported in a cool and ventilated place to ensure the safety of personnel and the environment.