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What is the chemical structure of N-tert-butyl decahydroisoquinoline-3 (s) -carboxamide?
The chemical structure of "n-tert-butyl-decahydroisoquinoline-3 (s) -formamide" is involved in the field of organic chemistry. This compound is composed of a three-part structure.
The first is "n-tert-butyl". Tert-butyl is an alkyl group containing four carbon atoms. In its structure, the central carbon atom is connected to three methyl groups, forming a unique branched chain. In organic molecules, it often affects the physical and chemical properties of compounds due to its large steric resistance.
The second is the "decahydroisoquinoline" part. The isoquinoline is a nitrogen-containing heterocyclic aromatic hydrocarbon with the structure of benzopyridine. The "decahydro" indicates that the double bonds of the isoquinoline ring system are hydrogenated, that is, all unsaturated bonds on the ring are converted into single bonds, forming a fully hydrogenated saturated ring structure. This saturated structure endows the compounds with different stability and spatial configurations.
The end is "-3 (s) -formamide", which is connected to the formamide group at the 3rd position of the decahydro isoquinoline. The formamide group is formed by connecting a carbonyl group (C = O) with an amino group (-NH ²), and (s) indicates that the stereochemical configuration at this position is a specific S-type. The stereoconfiguration has important effects on the biological activity and optical properties of the compound.
These three parts are connected by specific chemical bonds to construct the unique chemical structure of "n-tert-butyl-decahydroisoquinoline-3 (s) -formamide", whose structural characteristics determine the chemical reaction and biological activity of the compound.
What are the main physical properties of n-tert-butyl decahydroisoquinoline-3 (s) -carboxamide
N-tert-butyl-decahydroisoquinoline-3 (S) -formamide is a kind of organic compound. Its physical properties are quite impressive.
When talking about the melting point, the melting point of this substance may be within a certain range, but the melting point may also vary depending on the preparation method and purity. The melting point can be determined by differential scanning calorimetry or capillary method.
As for the boiling point, under a specific pressure, it will reach a certain temperature and boil. Changes in pressure have a great impact on the boiling point. If the boiling point appears at standard atmospheric pressure, this value can be accurately measured by distillation experiments. < Br >
In terms of solubility, it may exhibit good solubility in organic solvents, such as ethanol, dichloromethane, etc., because the molecular structure of the compound is suitable for the intermolecular forces of organic solvents. However, in water, its solubility may be poor, because the hydrophobic part of the molecule is large and the interaction with water molecules is weak.
In appearance, it may be a white to off-white solid powder with a fine texture. This is a common form, but it may vary slightly depending on the preparation process. < Br >
Density is also one of its important physical properties. Although the exact value needs to be determined by precise experiments, its density may be in a similar range to that of compounds with similar structures, which can help chemists to predict its related behavior when processing the substance.
In addition, the refractive index of this substance is also of characterization significance. The refractive index reflects the degree of refraction of light when passing through the substance, and can be used in purity detection and structural analysis. Although the specific refractive index value needs to be accurately measured by a specific instrument, it is of indispensable value for the identification and study of this compound.
N-tert-butyl decahydroisoquinoline-3 (s) -carboxamide is used in which areas
N-tert-butyl-decahydroisoquinoline-3 (S) -formamide is useful in many fields. In the field of medicine, this compound may exhibit significant biological activity due to its unique chemical structure. Or it can be used as a lead compound, which has been carefully modified and optimized by chemists, and is expected to be developed into a new type of drug for the treatment of specific diseases. The spatial structure and functional groups of the geine compound can precisely fit with the target in the body, just like the joint of mortise and tenon, so as to regulate the physiological process and achieve the effect of treating diseases.
In the field of materials science, N-tert-butyl-decahydroisoquinoline-3 (S) -formamide also has potential applications. Due to its special physical and chemical properties, it can be integrated into polymer materials as an additive. In this way, it can improve the properties of materials, such as enhancing the stability and flexibility of materials, or even endowing materials with special optical and electrical properties, opening up new paths for the development of materials science.
Furthermore, in the field of organic synthesis, this compound can be used as a key intermediate. Organic chemists use various reactions to build more complex organic molecules. The activity check points in its structure, like the hub of chemical reactions, can trigger various transformations, facilitate the synthesis of organic compounds with specific functions and structures, and promote the progress of organic synthesis chemistry. In conclusion, N-tert-butyl-decahydroisoquinoline-3 (S) -formamide has great application potential in the fields of medicine, materials science, organic synthesis, etc., just like jade waiting to be cut, the future can be expected.
What are the synthesis methods of n-tert-butyl decahydroisoquinoline-3 (s) -carboxamide
There are many ways to synthesize N-tert-butyl-decahydroisoquinoline-3 (S) -formamide. One method can also start from decahydroisoquinoline-3 (S) -formic acid. The formic acid is first mixed with dichlorosulfoxide, and under appropriate warm conditions, the two react to produce decahydroisoquinoline-3 (S) -formyl chloride. During this reaction, it is necessary to pay attention to the reaction temperature and do not make it too high to avoid side reactions.
After obtaining this formyl chloride, slowly drop it into the reaction system containing tert-butylamine. The molar ratio of tert-butyl amine to formyl chloride should be carefully considered, usually slightly higher than 1:1, so that the reaction can proceed in the direction of generating the target product. During the reaction, an appropriate amount of acid binding agent, such as triethylamine, may be added to neutralize the acid generated by the reaction and promote the smooth progress of the reaction. In this step, under mild conditions, N-tert-butyl-decahydroisoquinoline-3 (S) -formamide crude product can be obtained. After
, the crude product can be purified by column chromatography with a suitable eluent, such as a mixture of petroleum ether and ethyl acetate in a certain proportion, to obtain a pure target product.
Another method can be started from decahydroisoquinoline-3 (S) -ethyl formate. With a strong base such as sodium ethanol, the ethyl formate is first condensed to form the corresponding enolate intermediate. This intermediate meets tert-butyl isocyanate, and the two undergo nucleophilic addition reaction to construct the skeleton of the target product. After the reaction, the product is carefully treated with dilute acid to allow free precipitation. The product is further purified by means of recrystallization to obtain high-purity N-tert-butyl-decahydroisoquinoline-3 (S) -formamide.
What is the market outlook for n-tert-butyl decahydroisoquinoline-3 (s) -carboxamide
Now there is n-tert-butyl-decahydroisoquinoline-3 (s) -formamide, which is quite promising in the market situation.
This compound may have potential opportunities in the field of pharmaceutical research and development. Its unique structure or specific biological activity can be used to explore new drugs. For example, in the drug development of neurological diseases, its structure may be compatible with the action of neurotransmitter receptors or enzymes, or new drugs that regulate nerve conduction can be developed, so it may gain a place in the pharmaceutical market.
In materials science, it should not be underestimated. Its special molecular structure may endow the material with new properties. For example, in the modification of polymer materials, adding this substance may change the physical properties of the material, such as improving the flexibility and stability of the material, and then expand the application range of the material. It may be useful in aerospace, electronic equipment and other fields.
However, the road of its marketing activities is not smooth. The complexity of the synthesis process may cause high production costs. And the market's acceptance of new compounds requires strict testing and certification. Only by overcoming the synthesis problems, reducing costs and increasing efficiency, and passing various rigorous tests can we make a big impact on the market. Although there are obstacles ahead, its potential value is significant. With time and careful study, the market's prospects may shine brightly.