Chemical Name | 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid |
Molecular Formula | C13H9F2NO3 |
Molecular Weight | 265.21 |
Appearance | Solid (usually) |
Solubility | Slightly soluble in water |
Pka | Typically around 6 - 7 |
Melting Point | Reportedly in a certain temperature range (e.g., 250 - 260 °C) |
Boiling Point | Decomposes before boiling |
Color | Often white to off - white |
Odor | Odorless |
Stability | Stable under normal conditions |
Name | 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid |
Molecular Formula | C13H9F2NO3 |
Molecular Weight | 267.212 |
Appearance | Solid |
Physical State At Room Temperature | Solid |
Solubility In Water | Low |
Melting Point | 253 - 255 °C |
Pka Value | About 6.3 |
Chemical Class | Quinolone carboxylic acid |
Uv Absorption Maximum | Around 270 - 280 nm |
Density | N/A (no common reported value) |
Chemical Formula | C13H9F2NO3 |
Molecular Weight | 267.212 |
Appearance | Solid |
Melting Point | 255 - 257 °C |
Solubility In Water | Poorly soluble |
Pka Value | Approx. 6.1 |
Logp Value | 1.32 |
Crystal Structure | Monoclinic |
Odor | Odorless |
Stability | Stable under normal conditions |
Name | 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid |
Chemical Formula | C13H9F2NO3 |
Molar Mass | 267.21 g/mol |
Appearance | Solid (usually white or off - white powder) |
Physical State At Room Temp | Solid |
Solubility In Water | Poorly soluble |
Melting Point | Typically in a certain temperature range (needs more precise research) |
Acidity | Weakly acidic due to carboxylic acid group |
Uv Vis Absorption | Absorbs in certain UV regions related to its chromophoric groups |
What is the chemical structure of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid?
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid, its chemical structure is as follows. This compound belongs to the quinoline carboxylic acid class and is derived from the quinoline parent nucleus.
Looking at its structure, the quinoline parent nucleus is the root, and a cyclopropyl group is added at the 1st position. Cyclopropyl is a cyclic structure composed of three carbons, which has unique tension and reactivity. Introducing fluorine atoms at the 6th and 7th positions has high electronegativity, which can significantly change the electron cloud distribution of the compound, which has a great impact on its physicochemical properties and biological activities. The structure of 1,4-dihydro-4-oxo indicates that the 4-position is a carbonyl group, and the 1-4-position is a single bond obtained by double-bond hydrogenation. This structural feature affects the conjugation system of the molecule and affects the stability and reactivity of the compound. And 3-carboxylic acid, that is, the 3-position of the quinoline parent nucleus is connected to a carboxyl group, which is acidic and can participate in many chemical reactions. In drug design, it can often change the water solubility of the compound and the interaction with the target.
As a whole, the groups in this chemical structure interact with each other and cooperate to determine the unique properties of the compound. It may have important uses in medicine and other fields.
What are the main uses of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid, which is the name of a chemical substance. Its use is quite extensive, in the field of medicine, it is often used as a key intermediate for the synthesis of quinolones antibacterial drugs. Quinolones can inhibit the activity of bacterial DNA spin enzyme (bacterial topoisomerase II), hinder bacterial DNA replication, and then exhibit strong antibacterial effect. It can effectively fight many bacteria such as Escherichia coli, Staphylococcus aureus, etc. It has good curative effect on a variety of infectious diseases such as respiratory tract infections, urinary system infections, and intestinal infections. In the field of organic synthesis, this substance can be used as a basic raw material for the construction of many complex organic compounds due to its unique chemical structure. Due to its specific functional groups and structural properties, it can play a unique role in organic reactions, enabling chemists to create organic molecules with novel structures and specific properties, providing an important material foundation for the development of organic synthetic chemistry.
Furthermore, in the process of drug research and development, in-depth research has been carried out on 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid. Through structural modification and modification, it is expected to develop new drugs with stronger antibacterial activity, wider antibacterial spectrum, and lower toxic and side effects, adding new help to the cause of human health.
What are the synthesis methods of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid. This is an important compound in the field of chemistry, and its synthesis methods are numerous. The following will be described in detail.
First take a specific quinoline derivative and add an appropriate amount of cyclopropylation reagent, such as cyclopropyl halide, to a specific reaction vessel. This reaction needs to be carried out under the catalysis of a base, which can be potassium carbonate, sodium carbonate, etc. At a suitable temperature and duration, cyclopropyl can be successfully connected to the quinoline parent structure to obtain an intermediate containing cyclopropyl.
Then, fluorination is performed on the intermediate. To the reaction system of the intermediate, high-efficiency fluorinating reagents, such as Selectfluor, are added. This fluorination process requires strict control of the reaction conditions, temperature, reaction time, etc., in order to successfully introduce fluorine atoms at 6 and 7 positions, and then obtain the crude product of the target product. However, this crude product still contains impurities, and needs to be purified by recrystallization, column chromatography and other fine means to obtain high-purity 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid.
Furthermore, it can also be synthesized by the strategy of constructing quinoline rings. First, suitable aromatic compounds and carbonyl-containing compounds are used as starting materials, and the prototype of quinoline rings is constructed by condensation reaction. This condensation reaction may require acid or base as a catalyst, and at a specific temperature, after a certain period of time, the preliminary quinoline ring structure is obtained. After
, similar to the above, cyclopropylation and fluorination reactions are carried out in sequence. During cyclopropylation, the appropriate cyclopropylation reagent and reaction conditions are selected according to the activity of the selected starting material; the fluorination step should also pay attention to the characteristics and reaction parameters of the fluorination reagent to ensure that the reaction in each step is accurately advanced, and finally the pure target compound is obtained through the purification process.
In addition, there is a method that uses some natural products or compounds that already have part of the target structure as the starting point. By modifying and transforming their specific parts, key groups such as cyclopropyl and fluorine atoms are gradually introduced. This method requires in-depth understanding of the structure and reactivity of the starting compound, and ingenious design of the reaction route to achieve the synthesis target.
There are various methods for the synthesis of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid, each method has its own advantages and disadvantages, and the most suitable method should be selected according to the actual needs and conditions.
What are the physical properties of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid, this is an organic compound. Its physical properties are quite important and affect many properties of this compound.
First of all, the appearance of this substance is usually white to light yellow crystalline powder, with a fine texture, like fine sand, pure color and no variegated mottles. Looking at it, it feels pure.
Besides the melting point, the melting point of this compound is in a specific range, about [X] ° C. The determination of the melting point is the key to judging its purity and stability. When the temperature gradually rises to the melting point, this compound slowly melts from a solid state to a liquid state, just like ice and snow melted in the warm sun. This change requires precise temperature control to ensure that its properties are not affected.
Solubility is also an important physical property. It has poor solubility in water, just like a stone entering water, and is difficult to melt. However, in some organic solvents, such as ethanol and acetone, it can show good solubility, just like a fish entering water, swimming freely. This property has important applications in the process of chemical synthesis and separation purification. The appropriate solvent can be selected accordingly to realize the operation of the compound.
Its density is also fixed, about [X] g/cm ³. The physical quantity of density is related to the relationship between the mass and volume of the compound. In practical applications, whether it is weighing or calculating the dosage, the density factor needs to be considered to ensure accurate operation.
In addition, the stability of the compound is acceptable. Under normal temperature and pressure, it can maintain its own structure and properties unchanged, just like a calm old man, who has passed the years and remained silent. In case of extreme conditions such as high temperature, strong acid, and strong base, its structure may change, and its properties will also change accordingly.
The physical properties of this compound are rich and diverse, and each property is interrelated, which together determine its application and value in the field of chemistry. For chemical researchers, knowing its physical properties is the key to making good use of this material.
What is the market prospect of 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid?
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid, which is a key intermediate in the synthesis of quinolone antibacterial drugs. Looking at its market prospects, it can be described as vast and bright.
In the field of medicine, the demand for antibacterial drugs has always been high. Bacterial infections are widespread and pose a continuous threat to human health. With the increasing severity of bacterial resistance, the development of new and efficient antibacterial drugs is urgent. As an important intermediate, this compound can be derived from many new quinolone antibacterial drugs to deal with drug-resistant bacteria, so the demand for pharmaceutical research and development and production will continue to grow.
From the perspective of the chemical industry, the production technology of intermediates is also constantly improving. More efficient and environmentally friendly synthesis processes continue to emerge, which can not only improve the yield and quality of the compound, but also reduce production costs, thereby enhancing its competitiveness in the market. Many chemical companies have seized this opportunity and have invested in related production and research and development to further promote the expansion of market scale.
In addition, the continuous expansion of the global pharmaceutical market, especially the improvement of medical level and the release of medical demand in emerging economies, has created a larger market space for antimicrobial drugs synthesized with this intermediate. In summary, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxyquinoline-3-carboxylic acid is likely to achieve a double growth in market share and application scope in the future market due to its key position in the field of antimicrobial drugs, with a bright future.