Chemical Formula | C20H20N2O5S2 |
Molar Mass | 432.51 g/mol |
Appearance | Solid (predicted, no specific data available) |
Solubility In Water | Low (due to non - polar nature of many of its groups) |
Melting Point | No specific experimental data found, but predicted to be in a range typical for organic solids with such structure |
Boiling Point | No specific experimental data found, decomposition likely before boiling due to complex structure |
Odor | No specific data available, but may have a faint organic odor |
Density | No experimental density data, but can be estimated based on similar organic compounds |
Flash Point | No experimental data, but likely flammable as an organic compound |
What is the chemical structure of ethyl 2- {{[ (3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, 5-dimethylthiophene-3-carboxylate?
"Ethyl + 2 - { { [ ( 1,3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino } } - 4,5 - dimethylthiophene - 3 - carboxylate" is the English name of an organic compound. According to this name, its chemical structure can be deduced as follows:
The main chain of this compound is a thiophene ring, and ethyl carboxylate is connected to the 3 - position of the thiophene ring. This is because "ethyl" and "carboxylate" are connected to form this structure; each of the 4,5 - positions has a methyl (dimethyl), which means "dimethyl". The thiophene ring is connected to a complex side chain at the 2-position. The side chain starts with an amino group, which is connected to carbamothioyl, which is in turn connected to 1,3-benzodioxol-5-ylcarbonyl. The 1,3-benzodioxol-5-ylcarbonyl ring is formed by fusing the benzene ring with the dioxane ring, and the carbonyl is connected to the 5-position of the benzene ring.
In summary, the chemical structure of this compound is composed of a thiophene ring as the backbone, and a variety of specific groups are connected to each other at a specific position according to the naming convention, which together constitute its unique chemical structure.
What are the physical properties of ethyl 2- {{[ (3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, 5-dimethylthiophene-3-carboxylate?
This is an organic compound named "ethyl 2- {[ (1, 3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, 5-dimethylthiophene-3-carboxylate". Looking at its physical properties, the properties of this compound may be solid, because its structure contains many aromatic and heterocyclic structures. Such structures often enhance the intermolecular forces, resulting in a solid state at room temperature and pressure.
The determination of its melting point and boiling point is very important to confirm the purity of this compound and to distinguish the properties of substances. However, the exact melting point and boiling point values still need to be determined experimentally. Because the compound contains multiple polar groups, such as carbonyl, amino, and thiocarbonyl, etc., these polar groups cause strong interactions between molecules, or the melting point and boiling point are relatively high. < Br >
In terms of solubility, because it contains polar groups, it may have a certain solubility in polar solvents such as methanol, ethanol, and dimethyl sulfoxide (DMSO). The existence of aromatic rings and sulfur heterocycles makes it less soluble in non-polar solvents such as n-hexane and benzene.
The density of this compound is also an important physical property. However, without experimental data, it is difficult to determine its specific value. Its density may be affected by the compactness of the molecular structure, the type of atoms and the relative molecular weight. The relative molecular weight of this compound is large, the structure is complex and compact, or its density is large.
As for the refractive index, it reflects the ability of the compound to refract light, which is related to the molecular structure and the distribution of electron clouds. Because the compound contains aromatic and heterocyclic rings in conjugated system, the electron cloud has high fluidity and high refractive index. However, these are all speculations, and the exact physical properties must be based on experimental measurements.
What is the synthesis of ethyl 2- {{[ (3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, 5-dimethylthiophene-3-carboxylate?
Eh! To prepare ethyl + 2 - { { [ ( 1, 3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino } } - 4, 5 - dimethylthiophene - 3 - carboxylate, the method is as follows.
Start with 1,3 - benzodioxane - 5 - carboxylate, and make it with a suitable chlorination reagent, such as sulfuryl chloride, in a suitable reaction environment, or under heating and the presence of catalytic aids, into 1,3 - benzodioxane - 5 - formyl chloride.
Thiocarbamate is taken at one time, mixed with the 1,3-benzodioxyamyl-5-formyl chloride prepared earlier, and subjected to nucleophilic substitution in an alkaline medium, such as triethylamine and pyridine, to obtain [ (1,3-benzodioxyamyl-5-ylcarbonyl) aminothiocarbamyl] derivatives.
Compound with ethyl 4,5-dimethyl-3-thiophenecarboxylate as a substrate and combine it with the previously obtained [ (1,3-benzodioxyamyl-5-ylcarbonyl) aminothioformyl] derivative, or with the help of coupling reagents such as N, N '-dicyclohexyl carbodiimide (DCC) and catalyzed by 4-dimethylaminopyridine (DMAP), in organic solvents such as dichloromethane and tetrahydrofuran, through condensation reaction, the final ethyl + 2 - { { [ ( 1,3 -benzodioxol - 5 - Ylcarbonyl) carbamothioyl] amino } } - 4, 5 - dimethylthiophene - 3 - carboxylate.
Each step of the reaction requires attention to the temperature, time, and ratio of reactants. After the reaction, suitable separation and purification methods, such as column chromatography, recrystallization, etc. should be used to obtain pure products. In this way, the desired compound can be obtained.
Ethyl 2- {{[ (1, 3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, what are the application fields of 5-dimethylthiophene-3-carboxylate?
Ethyl 2- {{[ (1,3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino}} - 4,5 - dimethylthiophene - 3 - carboxylate, this compound may have potential applications in medicine, agriculture and other fields.
In the field of medicine, or with its unique chemical structure, it can be modified and optimized as a drug lead compound. Because it contains specific groups, it may be able to precisely bind to targets in vivo, such as certain enzymes or receptors, and then regulate physiological processes, finding new ways for disease treatment, such as targeting specific inflammatory pathways or tumor-related targets, promising to develop innovative therapies.
In the field of agriculture, or can be used as the basis for the creation of new pesticides. Its structural characteristics may endow it with a unique mechanism of action against pests and pathogens, which can precisely attack pests, and is environmentally friendly, low-toxic to non-target organisms. It meets the needs of modern green agriculture, adding new tools for crop protection and helping to improve the yield and quality of agricultural products.
In summary, ethyl 2- {[ (1,3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino}} - 4,5 - dimethylthiophene - 3 - carboxylate has important potential value in pharmaceutical research and development and agricultural plant protection, and needs to be further explored and developed to benefit mankind.
What is the market outlook for ethyl 2- {{[ (3-benzodioxol-5-ylcarbonyl) carbamothioyl] amino}} -4, 5-dimethylthiophene-3-carboxylate?
Guanfu ethyl + 2 - { { [ ( 1, 3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino } } - 4, 5 - dimethylthiophene - 3 - carboxylate The market prospect of this compound is worth exploring.
This compound may have potential in the field of pharmaceutical research and development. Gein 1,3 - benzodioxol - 5 - carbonyl and thiocarbamoyl structures often have unique activities in the design of drug molecules. It can interact with specific targets in organisms, such as participating in enzyme inhibition or receptor regulation. Therefore, in the process of creating new drugs, it may be able to emerge, provide new opportunities for conquering difficult diseases, and attract the attention of the pharmaceutical industry. It is expected to give rise to a related research boom. Market demand may increase due to the depth of scientific research and exploration.
In the field of materials science, it may also hold opportunities. The thiophene structure containing sulfur gives it certain electronic properties. It may be applied to the development of organic semiconductor materials, and it can be used in electronic devices, such as organic Light Emitting Diodes, field effect transistors, etc. With the increasing demand for new materials in the electronics industry, if its electrical performance advantages can be effectively exploited, it will find a place in the materials market and inject new impetus into the industrial upgrading.
However, its market expansion also faces challenges. The complexity of the synthesis process may lead to high production costs. To achieve large-scale production and wide application, it is necessary to optimize the synthesis route, improve the yield and reduce the cost. And its biosafety and environmental impact need to be further evaluated. Only through rigorous experiments to ensure that it has no significant harm to organisms and the environment can the market be smooth.
In summary, ethyl + 2 - { { [ ( 1,3 - benzodioxol - 5 - ylcarbonyl) carbamothioyl] amino } } - 4,5 - dimethylthiophene - 3 - carboxylate market prospects, opportunities and challenges coexist. It is up to scientific research and industry to work together to explore its potential and open up a vast world.