5s 6s 9r 5 Amino 6 2 3 Difluorophenyl 6 7 8 9 Tetrahydro 5h Cyclohepta B Pyridin 9 Ol
Fluorine Difluoride Fluorobenzene Fluorobenzyl Trifluorotoluene
(5S,6S,9R)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
Chemical Formula C16H16F2N2O
Molecular Weight 290.31
Physical State Solid (usually)
Appearance White to off - white powder
Melting Point Data needed
Boiling Point Data needed
Solubility In Water Low solubility
Solubility In Organic Solvents Soluble in some organic solvents like DMSO
Pka Data needed
Logp Data needed
Optical Activity Based on chiral centers, has optical activity
Stability Stable under normal conditions
Chemical Formula C16H16F2N2O
Molecular Weight 290.31
Iupac Name (5S,6S,9R)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
Chemical Formula C16H16F2N2O
Chemical Name (5S,6S,9R)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
Molecular Formula C16H16F2N2O
Molecular Weight 290.31
FAQ

What is the chemical structure of (5S, 6S, 9R) -5-amino-6- (2,3-difluorophenyl) -6,7,8,9-tetrahydro-5H-cycloheptano [b] pyridine-9-ol?

The chemical structure of (5S, 6S, 9R) -5-amino-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] pyran-9-ol is like an exquisite map hidden in the microscopic world, and it requires a rigorous scientific perspective and professional knowledge to understand its mysteries.

In the structure of this compound, the 5S, 6S, and 9R labels are the markers of a specific stereochemical configuration, just like the coordinates that precisely guide the arrangement and orientation of atoms in the chemical space. 5-Amino, as an important functional group, is like the key to activity, which can open the door of many chemical reactions and participate in many biological activities and chemical transformation processes.

6- (2,3-diethoxybenzyl) part, the benzyl ring structure of benzyl gives the molecule a certain rigidity and hydrophobicity, and the modification of diethoxy group adds the hydrophilicity and flexibility of the molecule. The two synergistically affect the physical and chemical properties of the molecule and its interaction with other substances.

6,7,8,9-tetrahydro-5H-cyclopento [b] pyran-9-ol The core ring structure constitutes the skeleton of the molecule. The combined ring system of cyclopento [b] pyran, due to its unique spatial configuration, determines the overall shape and conformation of the molecule, and the existence of 9-alcohol hydroxyl groups not only enhances the hydrophilicity of the molecule, but also acts as hydrogen bond donors or receptors, participating in intermolecular interactions, which has a profound impact on its behavior in solution and binding mode with biological macromolecules.

In summary, the chemical structure of (5S, 6S, 9R) -5-amino-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] pyran-9-ol is composed of various functional groups and a cyclic skeleton. Each part interacts and collaborates to shape the unique chemical and biological properties of this compound.

What are the main physical properties of (5S, 6S, 9R) -5-amino-6- (2,3-difluorophenyl) -6,7,8,9-tetrahydro-5H-cycloheptano [b] pyridine-9-ol?

(5S, 6S, 9R) -5-hydroxy-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] indole-9-ol, this substance has a variety of important physical properties.

Looking at its boiling point, due to the presence of polar groups such as hydroxyl and ether bonds in the molecule, hydrogen bonds can be formed between molecules, resulting in increased intermolecular force, so the melting boiling point is relatively high. This property is extremely critical in the separation and purification of this substance, and it can be purified by means of distillation, recrystallization, etc. according to the difference in melting boiling point.

In terms of solubility, because the molecule contains polar hydroxyl groups, and also has relatively non-polar benzyl and cyclopentoindole structures, it has a certain solubility in polar solvents such as methanol and ethanol, but poor solubility in non-polar solvents such as n-hexane. This property is of great significance when extracting the substance from the reaction system. According to the difference in solubility, a suitable solvent can be selected to achieve effective extraction.

In terms of optical rotation, the compound has multiple chiral centers (5S, 6S, 9R), which determines its optical rotation. This property is crucial in the field of drug development. Enantiomers of different configurations may exhibit very different pharmacological activities, metabolic processes and toxicity in vivo.

In summary, the physical properties of (5S, 6S, 9R) -5-hydroxy-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] indole-9-ol, such as melting point, solubility and optical rotation, have far-reaching implications for its research and application in chemical synthesis, drug development, separation and analysis, and many other fields.

What are the synthesis methods of (5S, 6S, 9R) -5-amino-6- (2,3-difluorophenyl) -6,7,8,9-tetrahydro-5H-cycloheptano [b] pyridine-9-ol?

The synthesis of (5S, 6S, 9R) -5-hydroxy-6- (2,3-diethylfuranyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] pyran-9-one is an interesting topic in organic synthetic chemistry. The synthesis of this compound can be achieved in multiple ways.

First, the key carbon-carbon bonds and functional groups can be formed by starting from the substrate and reacting in multiple steps. First, the specific position of the substrate is functionalized to make the substrate have a reactive activity check point. For example, a cyclic compound containing a suitable substituent is used as the starting material, and the desired (2,3-diethylfuran) fragment is introduced through a nucleophilic substitution reaction. This nucleophilic substitution reaction requires careful selection of nucleophilic reagents and reaction conditions. For example, a moderately basic alkaline agent is selected to promote the activity of the nucleophilic reagent while avoiding unnecessary side reactions of the substrate.

Subsequently, for the introduction of hydroxyl groups, an oxidation reaction can be used. For example, a specific carbon-hydrogen bond is oxidized to a hydroxyl group under mild conditions with a suitable oxidant. This step requires strict control of the amount of oxidant and the reaction time to prevent excessive oxidation and damage to the product structure.

Second, from the perspective of reverse synthesis analysis. The target molecule (5S, 6S, 9R) -5-hydroxy-6- (2,3-diethylfuran) -6,7,8,9-tetrahydro-5H-cyclopento [b] pyran-9-one was disassembled into several simple fragments. Starting from the key fragments, the cyclopento [b] pyran skeleton was constructed by cyclization reaction. In the cyclization reaction, the selection of suitable catalysts and reaction solvents is crucial. If Lewis acid catalysts are selected, the cyclization reaction in the molecule can be effectively promoted, and the polarity and solubility of the solvent will significantly affect the reaction rate and selectivity. < Br >
In the construction of the (2,3-diethylfuranyl) part, it can be achieved by condensation reaction. Using the corresponding aldehyde and ketone compounds as raw materials, under basic catalysis, hydroxyaldehyde condensation and other reactions occur to form a furan ring structure, and diethyl substituents are introduced. During the reaction process, attention should be paid to the regulation of the proportion of substrates and the reaction temperature, so that the reaction proceeds in the desired direction.

In addition, metal-organic chemistry methods can also be used. Metal-organic reagents are used to participate in the carbon-carbon bond formation reaction. If organolithium reagents or Grignard reagents are used to react with suitable halogenates, the construction of key carbon-carbon bonds can be achieved. In this process, the preparation of metal-organic reagents needs to be carried out under anhydrous and oxygen-free conditions to ensure their activity and stability. Subsequently, the obtained intermediates are transformed into functional groups, and hydroxyl and carbonyl groups are gradually introduced, and the final synthesis target is (5S, 6S, 9R) -5-hydroxy-6- (2,3-diethylfuran) -6,7,8,9-tetrahydro-5H-cyclopentano [b] pyran-9-one.

What are the applications of (5S, 6S, 9R) -5-amino-6- (2,3-difluorophenyl) -6,7,8,9-tetrahydro-5H-cycloheptano [b] pyridine-9-ol?

(5S, 6S, 9R) - 5-hydroxy-6- (2,3-diethoxybenzyl) - 6,7,8,9-tetrahydro-5H-cyclopento [b] pyridine-9-one is used in medicine, chemical synthesis and other fields.

In the field of medicine, it can be used as a pharmaceutical intermediate to help develop drugs with specific biological activities. Due to its unique chemical structure, it can interact with specific targets in organisms. For example, in the development of drugs for neurological diseases, it may be possible to chemically modify compounds with high affinity and selectivity for neurotransmitter receptors by virtue of their structural properties, in order to regulate neurotransmitter transmission, and then provide new strategies for the treatment of neurological diseases such as Parkinson's disease and Alzheimer's disease.

In the field of chemical synthesis, (5S, 6S, 9R) -5-hydroxy-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopentano [b] pyridine-9-one can be used as a key synthesis block. With its multi-functional group characteristics, it can combine with other organic compounds through various organic reactions, such as nucleophilic substitution, oxidation-reduction reaction, etc., to construct complex organic macromolecules. In the synthesis of new materials, by ingeniously designing the reaction path, it can be introduced into the main chain or side chain of the polymer to endow the material with special physical and chemical properties, such as improving the solubility and thermal stability of the material, or endowing the material with optical activity, laying the foundation for the development of high-performance new materials.

What is the market prospect of (5S, 6S, 9R) -5-amino-6- (2,3-difluorophenyl) -6,7,8,9-tetrahydro-5H-cycloheptano [b] pyridine-9-ol?

What is the market prospect of (5S, 6S, 9R) -5-amino-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] indole-9-one?

Although this specific compound is not directly mentioned in Tiangong Kaiwu, it contains insights into various things and insights into processes and markets, which can be used to discuss the past and the present.

In the traditional Chinese business philosophy, the demand for products comes from people's livelihood and the use of all parties. If this (5S, 6S, 9R) -5-amino-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] indole-9-one, if it can be used in the field of medicine, through exquisite methods, become a good medicine for the world and cure all kinds of diseases, it will attract the attention of physicians and drug dealers. Such as the medicine prepared by the ancient good prescription, if the efficacy is significant, the reputation will spread far, and there will be many buyers, and the market prospect will be broad.

Furthermore, in the chemical industry and other fields, if this compound can be used as a key raw material, through ingenuity of craftsmen, it can be turned into various exquisite and useful things, such as ancient exquisite equipment, beautiful fabric dyes, etc., which are circulated in business, they can open up a market world.

However, the market is also unpredictable. It is necessary to observe the situation in the world. If the four sides are stable and people's livelihood is prosperous, the demand for medicine and chemical products may rise steadily; if there are natural and man-made disasters, the situation is turbulent, and the market may suffer twists and turns. And the competition of peers should not be underestimated. If others explore its uses first and seize the opportunity, it will also affect its market prospects. In conclusion, if it can be properly utilized and its efficacy is exerted, (5S, 6S, 9R) -5-amino-6- (2,3-diethoxybenzyl) -6,7,8,9-tetrahydro-5H-cyclopento [b] indole-9-one may have a considerable market prospect.