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What is the chemical structure of pyridine-3-carboxylate ethyl 6- [ (4,4-dimethyl-3, 4-dihydro-2H-thiochromen-6-yl) ethynyl]?
This is the name of the organic compound, according to this name, its chemical structure is as follows:
The main structure consists of three parts. One is the pyridine ring, and the third position of the pyridine ring is connected to the carboxylic acid ethyl ester group, that is, the -COOCH -2 CH 🥰 structure, which is the part of the pyridine-3-carboxylic acid ethyl ester. Second, the sixth position of the pyridine ring is connected to another structure through the acetylene group (-C ≡ C -). Third, the connected structure is 4,4-dimethyl-3,4-dihydro-2H-thiochromene, and it is connected to the sixth position of the thiochromene.
4,4-dimethyl-3,4-dihydro-2H-thiochromene, which can be regarded as a derivative of benzothian. Its parent nucleus is benzothian, that is, a benzene ring is merged with a sulfur-containing hexahedral ring. At the 3,4 position, it is a dihydro structure, that is, the 3,4 position of the hexahedral heterocycle is hydrogenated and saturated with double bonds; at the 4 position, there are two methyl substitutions.
In summary, the chemical structure of this compound is composed of pyridine-3-carboxylic acid ethyl ester moiety, which is connected to 4,4-dimethyl-3,4-dihydro-2H-thiochromene-6-group by ethylene group.
What are the main physical properties of ethyl 6- [ (4,4-dimethyl-3, 4-dihydro-2H-thiochromen-6-yl) ethynyl] pyridine-3-carboxylate?
Ethyl + 6 - [ (4,4 - dimethyl - 3,4 - dihydro - 2H - thiochromen - 6 - yl) ethynyl] pyridine - 3 - carboxylate, the physical rationality of this compound has been investigated. Its outer layer or solid layer, because the molecule contains aromatic group, alkynyl group and ester group, etc., resulting in the molecular force, easy to form solid layer. In terms of melting and boiling, the azeotrope system of aromatic group and methyl group and other substituents can increase the molecular force and push the melting and boiling phase to high. However, due to certain resistance, the non-soluble part makes it poor in water, and it is soluble in water. However, in some soluble compounds such as dichloromethane and chloroform, due to the principle of similar miscibility, there may be a certain solubility. Its density depends on the concentration of molecules, atomic weight distribution, or slightly higher than the density of water. Therefore, the physical rationality of this compound is determined by its molecules. In the study of synthesis and phase domains, it is essential to master its physical rationality.
What are the common synthesis methods of ethyl 6- [ (4,4-dimethyl-3, 4-dihydro-2H-thiochromen-6-yl) ethynyl] pyridine-3-carboxylate?
Ethyl 6- [ (4,4 - dimethyl - 3,4 - dihydro - 2H - thiochromen - 6 - yl) ethynyl] pyridine - 3 - carboxylate is an organic compound, and its common synthesis method is as follows:
The choice of starting material, when it is a sulfur-containing, pyridine-containing compound with a specific structure. In the ancient way, or first find the raw material containing 4,4 - dimethyl - 3,4 - dihydro - 2H - thiochromene structure, and its 6 - position needs to have a reactive activity check point, such as halogen atoms. At this check point, the ethynyl fragment is introduced by the alkynylation reaction. This alkynylation reaction, or the Sonogashira coupling reaction catalyzed by palladium. In this reaction, the palladium catalyst is the main one in the battle and controls the reaction process. An organic base, such as triethylamine, is required to assist the reaction and adjust the acid-base environment of the reaction system.
In addition, the ethyl pyridine-3-carboxylate part, or based on pyridine, is carboxylated to introduce a carboxyl group at the 3-position, and then is esterified with ethanol to form a pyridine-3-carboxylate ethyl ester structure. After
, the 4,4-dimethyl-3,4-dihydro-2H-thiochromene fragment containing the alkynyl group is combined with ethyl pyridine-3-carboxylate. This binding step, or by means of palladium catalysis, makes the two precisely connected to obtain the target product Ethyl 6- [ (4,4-dimethyl-3,4-dihydro-2H-thiochromen-6-yl) ethynyl] pyridine-3-carboxylate. After each step of reaction, it needs to be separated and purified by methods, such as column chromatography, to remove impurities and maintain the purity of the product. The control of reaction conditions, such as temperature and reaction time, is crucial to success and failure, and fine adjustment is required to smooth the synthesis process and obtain this compound.
What are the applications of ethyl 6- [ (4,4-dimethyl-3, 4-dihydro-2H-thiochromen-6-yl) ethynyl] pyridine-3-carboxylate?
Ethyl-6- [ (4,4-dimethyl-3,4-dihydro-2H-thiochromene-6-yl) ethynyl] pyridine-3-carboxylic acid ester, this compound has potential applications in many fields such as medicine and materials.
In the field of medicine, it may be used as a drug lead compound. Due to the unique thiochromene and pyridyl carboxylate fragments in its structure, it endows molecules with specific spatial structures and electronic properties, or can closely bind to specific targets in organisms, such as proteins and enzymes. Through reasonable structural modification and optimization, it is expected to develop new anti-cancer and anti-inflammatory drugs. As in the past, many compounds have been delicately modified to become a good remedy for the world.
In the field of materials, this compound may have unique photoelectric properties. The conjugated system of thiochromene structure may endow it with good light absorption and electron transport capabilities. It can be used to prepare organic optoelectronic materials, such as organic Light Emitting Diode (OLED), solar cells, etc. Just as ancient craftsmen searched for high-quality materials, after repeated experiments, they finally found something usable. This compound may add new color to the field of materials.
In the field of chemical synthesis, its complex structure can be used as a challenge target in synthetic chemistry. Inspire chemists to develop novel and efficient synthesis methods to construct such structures. By studying its synthetic route, it may be possible to promote the development of organic synthetic chemistry, invent new reaction mechanisms and strategies, and continuously explore and innovate like the ancients.
What is the market outlook for ethyl 6- [ (4,4-dimethyl-3, 4-dihydro-2H-thiochromen-6-yl) ethynyl] pyridine-3-carboxylate?
Guanfu ethyl + 6- [ (4,4-dimethyl-3,4-dihydro-2H-thiochromene-6-yl) ethynyl] pyridine-3-carboxylic acid ethyl ester, its market prospects are expected by everyone.
From its chemical structure, its unique structure endows it with potential characteristics, which may have considerable applications in the field of pharmaceutical research and development. Today's pharmaceutical industry is eager to explore new compounds, and is committed to discovering those with special activities to treat various diseases. Due to its novel structure or ability to interact with specific biological targets, this compound may become the cornerstone of the creation of new drugs through in-depth research and experiments, and is expected to emerge in the treatment of anti-tumor, anti-viral and many other diseases. Therefore, it has the potential to develop new therapies in the pharmaceutical market, and the prospect may be very bright.
In the field of materials science, its special structure or special physical and chemical properties. For example, in the field of organic optoelectronic materials, it may exhibit unique optical and electrical properties, which can be used to develop new optoelectronic devices, such as organic Light Emitting Diodes, solar cells, etc. With the continuous advancement of science and technology, the demand for high-performance materials is increasing day by day. If this compound can meet the relevant performance requirements, it will be able to gain a place in the material market and be widely used.
However, its marketing activities also face challenges. The process of synthesizing this compound may be complex and expensive. If the synthesis route cannot be optimized and the cost can be reduced, it may be difficult to apply it on a large scale in the market. And the research and development of new drugs requires long and rigorous clinical trials to prove their safety and effectiveness. This process consumes huge resources and time. In terms of material application, its long-term stability and compatibility also need to be deeply studied.
Overall, ethyl + 6- [ (4,4-dimethyl-3,4-dihydro-2H-thiochromene-6-yl) ethynyl] pyridine-3-carboxylate ethyl ester has considerable market potential, but to fully realize it, it is necessary to cooperate with scientific research and industry to overcome the problems of synthesis and research and development in order to open up a broad market prospect.