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What is the chemical structure of 3-Bromo-2,3,4, 5-Tetrahydro-2H-Benzo [B] Azepin-2-One
This is an investigation into the chemical structure of 3-bromo-2,3,4,5-tetrahydro-2H-benzo [b] azepine-2-one. The core structure of this compound is a benzoxazepine ring, which is formed by fusing a benzene ring with a seven-membered azepine ring. In this structure, in the main structure of 2H-benzo [b] azepine-2-one, a bromine atom is introduced at position 3, and the tetrahydro state is at positions 2, 3, 4, and 5.
Looking at this benzoxazepine ring, the nitrogen atom is a part of the seven-membered ring, which gives the compound unique chemical activity and electronic properties. The substitution of bromine atom at position 3 significantly affects the polarity, reactivity and steric resistance of the molecule due to the electronegativity and volume effect of bromine. The tetrahydro structure at positions 2, 3, 4, and 5 decreases the degree of unsaturation of the molecule, affects its conjugate system, and then changes its physical and chemical properties. In this way, the chemical structure of 3-bromo-2,3,4,5-tetrahydro-2H-benzo [b] azepine-2-one is composed of a specific fused ring system, substituents, and saturation degree. The interaction of each part determines the overall characteristics and reactivity of the compound.
3-Bromo-2,3,4, 5-Tetrahydro-2H-Benzo [B] What are the physical properties of Azepin-2-One
3 - Bromo - 2,3,4,5 - Tetrahydro - 2H - Benzo [b] Azepin - 2 - One is an organic compound. The physical properties of this compound are very important, and it is related to its performance in various chemical processes and practical applications.
Its appearance may be a crystalline solid, and its color is often white to off-white. This color and morphology can help chemists to infer its purity and characteristics during preliminary observation.
In terms of melting point, the specific melting point value is a key physical index for identifying the compound. Accurate determination of the melting point can effectively distinguish this compound from other structures that are similar. The determination of the melting point can be achieved by means of a melting point meter. Under standard experimental conditions, the exact melting point data can be obtained.
Solubility is also a key physical property. In organic solvents, such as common ethanol and dichloromethane, their solubility may show differences. In ethanol, there may be a certain solubility, which may be caused by the interaction between the compound molecule and the ethanol molecule, such as hydrogen bonding, van der Waals force, etc. In dichloromethane, its solubility may be different, or the way it interacts with the compound is different due to the polarity and molecular structure of dichloromethane.
In addition, the density of the compound is also a physical property that cannot be ignored. Density data can help to accurately calculate the dosage when it comes to solution preparation, reaction material metering, etc. Its density can be determined by specific experimental methods, such as the symmetry flask method.
Its boiling point information is also of great significance to its separation and purification process. Knowing the boiling point can set suitable temperature conditions in separation operations such as distillation to achieve effective separation of the compound from other components.
In summary, the many physical properties of 3 - Bromo - 2,3,4,5 - Tetrahydro - 2H - Benzo [b] Azepin - 2 - One, from appearance, melting point, solubility, density to boiling point, play an indispensable role in chemical research, production practice and other fields.
What is the common synthesis method of 3-Bromo-2,3,4, 5-Tetrahydro-2H-Benzo [B] Azepin-2-One
The common synthesis methods of 3-bromo-2,3,4,5-tetrahydro-2H-benzo [b] azepine-2-one are the key research directions in the field of chemistry. One of the common synthesis paths is to use a specific aromatic compound as the starting material. First, the aromatic compound is halogenated with a bromine-containing reagent to introduce bromine atoms precisely. In this step, attention should be paid to the control of reaction conditions, such as temperature and solvent selection, because these factors have a great influence on the selectivity of bromine atom substitution positions.
Then, the intermediate product containing bromine is cyclized with a specific unsaturated nitrogen heterocyclic compound. This cyclization reaction often requires the assistance of specific catalysts to promote intramolecular cyclization and build the basic skeleton of benzo [b] azepines. During the reaction process, the type and amount of catalysts, as well as the control of reaction time, all have significant effects on the yield and purity of the product.
Furthermore, some synthesis methods use transition metal-catalyzed coupling reactions. With the unique activity of transition metal catalysts, small molecules with different functionalizations can be efficiently coupled to build the structure of the target compound. In this process, the selection of transition metal catalysts, such as palladium, nickel and other metal catalysts, and the selection of ligands are of great significance for optimizing the reaction path, improving the reaction efficiency and selectivity.
In addition, some synthesis strategies involve functional group modification of starting materials or intermediates. Through suitable functional group conversion reactions, such as oxidation, reduction, esterification, etc., the complete structure of the target molecule is gradually constructed. Each step of functional group conversion requires careful selection of suitable reaction conditions and reagents according to the characteristics of the reaction substrate to ensure that the reaction proceeds in the expected direction, and finally successfully obtains 3-bromo-2,3,4,5-tetrahydro-2H-benzo [b] azepine-2-one.
3-Bromo-2,3,4, 5-Tetrahydro-2H-Benzo [B] What are the main application fields of Azepin-2-One
3 - Bromo - 2,3,4,5 - Tetrahydro - 2H - Benzo [b] Azepin - 2 - One is also an organic compound. Its main application field is quite wide, and in the field of medicinal chemistry, this compound is often used as a key intermediate. Due to its unique chemical structure, it can be converted into substances with specific pharmacological activities through many chemical reactions. For example, when developing new antidepressant drugs, it may provide a unique molecular structure for synthesis, helping to create more effective therapeutic agents with less side effects.
It also has potential applications in materials science. Or it can be used to synthesize materials with special optical or electrical properties. For example, through rational design and modification, it is expected to impart specific fluorescence properties to materials, which may play an important role in the development and application of new functional materials in the fields of Light Emitting Diode (LED) materials and optical sensors.
In the field of organic synthetic chemistry, it can participate in the construction of complex organic molecules as a key building block. With its functional group characteristics, it can realize multi-step organic synthesis reactions and construct organic compounds with diverse structures and functions, providing organic synthetic chemists with rich synthesis strategies and paths to prepare various novel organic compounds and promote the development of organic synthetic chemistry.
3-Bromo-2,3,4, 5-Tetrahydro-2H-Benzo [B] Azepin-2-One What are the precautions during storage and transportation
3 - Bromo - 2, 3, 4, 5 - Tetrahydro - 2H - Benzo [B] Azepin - 2 - One is an organic compound. Many things should be paid attention to when storing and transporting.
First words storage. This compound should be placed in a cool, dry and well ventilated place. Because the cool environment can suppress its chemical reactions caused by excessive temperature, drying can avoid changes such as moisture hydrolysis, and good ventilation can prevent the accumulation of harmful gases. And be sure to keep away from fire and heat sources, because it may be flammable or easy to react violently with heat and open flames, causing fire or even explosion risk. Furthermore, it should be stored separately from oxidizing agents, acids, alkalis, etc. Due to its active chemical properties, contact with such substances can easily trigger chemical reactions, damage its quality or even lead to safety accidents.
Times and transportation. When transporting, the packaging must be solid and tight to prevent leakage. The packaging materials used must be able to withstand certain external shocks and environmental changes, and have good sealing performance. The transportation process should ensure that the container is not tilted, leaked or damaged. Transportation vehicles should also be equipped with corresponding fire fighting equipment and leakage emergency treatment equipment to prevent accidents on the way and respond in time. Escort personnel should also be familiar with the characteristics of the compound and emergency response methods, and the transportation route should avoid densely populated areas and important facilities, so as to reduce the harm to the public and important facilities in the event of an accident.