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What is the chemical structure of 1-ethyl-1,4-dihydro-6, 7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid?
The chemical structure of 1-ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid is quite delicate. This compound belongs to quinoline carboxylic acid derivatives. Looking at its structure, the quinoline ring is the core structure, and the substituents on it have their own positions and perform their respective functions.
The first position of the quinoline ring is connected with ethyl. The introduction of this ethyl group has an impact on the spatial structure and physicochemical properties of the compound, or can change its lipophilicity, which in turn affects its transport and distribution in organisms. The presence of this carbonyl group makes the check point have certain reactivity and can participate in many chemical reactions, such as nucleophilic addition.
6 and 7 positions are connected by methylene dioxy groups. This structural unit is unique. The presence of methylene dioxy groups may enhance the stability of the molecule, and because of its conjugation effect, it also adjusts the electron cloud distribution of the compound, affecting its spectral properties and chemical reactivity. The carboxyl group of the 3 position gives the compound acidity and can participate in acid-base reactions. In drug design, this carboxyl group is crucial for the interaction between the compound and the target, or can be bound to the receptor through ionic bonds.
Overall, the chemical structure of 1-ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid is related to each other, which jointly determines its physical, chemical and biological activities and many other properties. It may have potential application value in the fields of organic synthesis and drug development.
What are the main physical properties of 1-ethyl-1,4-dihydro-6, 7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid?
1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, Chinese name is often 1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, this is an organic compound with specific physical and chemical properties, Jin for Jun detailed its main physical properties.
Looking at its properties, it is mostly white to light yellow crystalline powder under normal conditions, and the powder is fine. This form is conducive to its uniform dispersion in many chemical reaction systems, full contact with other reactants, and then promote the smooth progress of the reaction.
When talking about the melting point, it is about 250-255 ° C. The melting point is the inherent property of the compound, and this value accurately reflects the specific temperature conditions required for the substance to transition from solid to liquid. In the fields of substance identification and purity detection, melting point determination is a key means. If the melting point of the sample is consistent with the known standard melting point and the melting range is narrow, it can be preliminarily determined that the purity is high; conversely, if the melting point deviates or the melting range is too wide, it suggests that the sample may be mixed with impurities.
In terms of solubility, the substance is slightly soluble in water. The water molecules are closely connected by hydrogen bonds to form a relatively stable structure. Although the molecular structure of this compound contains polar groups, the overall degree of polarity is limited, and the interaction with water molecules is weak, resulting in a low degree of solubility in water. However, it is soluble in some organic solvents, such as dimethyl sulfoxide (DMSO), N, N-dimethyl formamide (DMF) and other polar organic solvents. In DMSO, the compound can interact with solvent molecules by means of intermolecular forces to achieve good solubility. This property provides convenience for its application scenarios in organic synthesis, drug research and development, and researchers can use these organic solvents to prepare it into a homogeneous solution for subsequent experimental operations.
In addition, the chemical properties of this compound are relatively stable at room temperature and pressure. However, under extreme conditions such as high temperature, strong acid, strong base or strong oxidant, some chemical bonds in its molecular structure, such as quinoline ring, methylene dioxy group, may undergo chemical changes such as fracture or rearrangement, resulting in changes in its original chemical structure and properties.
What are the applications of 1-ethyl-1,4-dihydro-6, 7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid?
1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid (1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid), this compound has applications in medicine, chemical industry and many other fields.
In the field of medicine, it is often used as a key intermediate in the preparation of quinolone antibacterial drugs. Quinolone antibacterial drugs have broad-spectrum antibacterial activity and have significant inhibitory effects on both Gram-positive and Gram-negative bacteria. With the unique chemical structure of this compound, the synthesized antibacterial drug can effectively act on the DNA rotatase or topoisomerase IV of bacteria, interfering with the replication, transcription and repair of bacterial DNA, and then realize the antibacterial effect and play an important role in anti-infection treatment.
In the chemical industry, it can be used to synthesize dyes or pigments with special properties. Due to the quinoline ring and related substituents in its structure, the compound has a unique electron cloud distribution and conjugation system, so that the dyes or pigments synthesized based on it may exhibit excellent color, light resistance and stability, and have application potential in textile, printing and other industries.
In addition, in the study of organic synthetic chemistry, this compound can be used as a model molecule to explore novel organic synthesis reactions and methods due to its complex and unique structure. Chemists transform and modify it by various functional groups to study the mechanism, selectivity and efficiency of the reaction, promote the development of organic synthetic chemistry, and lay the foundation for the development of new functional materials and drugs.
What are the preparation methods of 1-ethyl-1,4-dihydro-6, 7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid?
1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, that is, 1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, its preparation method is as follows:
Prepared in the past, multi-step chemical synthesis. First, appropriate starting materials, such as phenols or aromatic compounds with specific substituents, are used as the basis for the reaction. < Br >
One method is to first take the phenol with the corresponding substituent and make it alkylated with halogenated alkanes, such as ethyl halides, under the catalysis of bases to introduce ethyl groups. Then, through a series of condensation and cyclization steps, the mother nucleus of quinoline is constructed. Phenolic derivatives can be condensed with carbonyl-containing compounds under the catalysis of acids or bases to form a preliminary cyclized structure.
When constructing 6,7-methylene dioxy structures, the corresponding bis-hydroxy compounds are often reacted with formaldehyde or paraformaldehyde under acidic conditions to form methylene dioxy groups. In this step, attention should be paid to the control of reaction conditions to prevent overreaction or side reactions.
After the quinoline parent nucleus and the methylenedioxy structure are prepared, the group at a specific position is oxidized to a carbonyl group through an oxidation step to obtain a 4-oxo structure. Finally, under suitable conditions, a carboxyl group is introduced, such as a carboxyl-containing reagent, through substitution or other related reactions, to obtain 1-ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinoline carboxylic acid. The whole preparation process, the reaction conditions of each step, such as temperature, pH, and the proportion of reactants, need to be carefully adjusted to obtain a high-purity product.
What are the safety and toxicity of 1-ethyl-1,4-dihydro-6, 7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid?
1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, that is, 1 - ethyl - 1,4 - dihydro - 6,7 - methylenedioxy - 4 - oxo - 3 - quinolinecarboxylic acid, the investigation of the safety and toxicity of this substance is quite important.
Ancient books say: "The properties of all things have advantages and disadvantages. Observe whether they are used properly and whether they are harmful." For 1-ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinoline carboxylic acid, its safety is multi-terminal. If prepared, stored and used properly, its latent risk can be reduced. However, when preparing, if the raw materials are impure and the process is wrong, impurities may be generated, which will affect its safety.
When it comes to toxicity, many previous studies have either detailed or slightly involved it. The apparent toxicity often depends on the dose, exposure route, and duration of action. At low doses, or the body can tolerate it without obvious adverse effects; however, if the dose is high, or exposed through specific routes, such as inhalation, ingestion, skin absorption, toxicity may occur. Its effect on organisms, or affect cell metabolism, or interfere with physiological functions. Such as affecting the activity of enzymes, causing intracellular biochemical reactions disorder; or acting on the nervous system, disturbing nerve conduction.
And different organisms have different toxic reactions to it. From the perspective of animal experiments, rodents, mammals, etc. may have different reactions. Or due to differences in physiological structure and metabolic capacity. Therefore, to evaluate its safety and toxicity, it is necessary to consider multiple aspects, synthesize experimental data, practical application scenarios, etc., in order to obtain a more accurate understanding, in order to avoid harm and benefit, and make good use of this product.