Chemical Formula | C15H9N |
Molecular Weight | 203.24 g/mol |
Appearance | Yellow - orange solid |
Melting Point | 177 - 181 °C |
Boiling Point | 390 - 392 °C |
Solubility In Water | Insoluble |
Solubility In Organic Solvents | Soluble in common organic solvents like ethanol, benzene |
Density | 1.247 g/cm³ |
Flash Point | 192.2 °C |
Uv Visible Absorption | Absorbs in the visible range, around 400 - 500 nm |
Pka | Basic, pKa value in a relevant range for heterocyclic amines |
What are the main uses of 3,4-benzoquinoline?
What are the main uses of 3, 2, 4-thiadiazole double light? This compound has a wide range of uses and is of great value in many fields.
In the field of medicine, it is often a key intermediate for the creation of new drugs. Due to the unique chemical structure of 3, 2, 4-thiadiazole double light, it can precisely bind to specific targets in organisms, and then exhibit many biological activities such as antibacterial, anti-inflammatory, and anti-tumor. For example, some studies are dedicated to modifying this structure to develop antibacterial drugs with better efficacy and fewer side effects to deal with the increasingly serious problem of bacterial drug resistance.
In the field of materials science, it also plays an important role. The 3,2,4-thiadiazole dual light can be used to prepare materials with special optical and electrical properties. For example, its introduction into polymer materials can significantly improve the fluorescence properties of the materials, making it suitable for optoelectronic devices such as organic Light Emitting Diode (OLED), improving the luminous efficiency and stability of the devices, and contributing to the development of a new generation of display technology.
In addition, in the agricultural field, 3,2,4-thiadiazole dual light can be used as an important raw material for the creation of pesticides. After rational design and modification, high-efficiency, low-toxicity and environmentally friendly pesticides can be developed for pest control, helping to improve crop yield and quality, while reducing the adverse impact on the ecological environment.
In summary, with its unique structure and diverse properties, 3,2,4-thiadiazole dual light has broad application prospects and important practical value in many fields such as medicine, materials, agriculture, etc., and is of great significance for promoting technological development and progress in various fields.
What are the physical properties of 3,4-benzoquinoline?
3,2,4-Thiadiazolopyridine light has many unique physical properties. It has good optical properties. Due to its special molecular structure, the conjugated system makes it have significant absorption and emission characteristics in specific wavelengths. It can be used in the field of fluorescent materials, emitting bright and stable fluorescence. It is suitable for fluorescent markers, and helps researchers clearly observe biomolecular activities in biological imaging and other fields.
Furthermore, it has certain electrical properties, and the distribution of intramolecular electron clouds gives it semiconductor properties. In organic electronic devices such as organic field effect transistors, rational design and modification may optimize the charge transfer performance of the device, improve the working efficiency and stability of the device.
In addition, thermal stability is also an important property. Due to the stability of the chemical bond energy and spatial structure in the molecule, its structure and properties are difficult to be destroyed at higher temperatures, which has obvious advantages in scenarios where high temperature resistant materials are required, such as optical or electronic devices in high temperature environments, which can ensure the stable operation of the material and reduce the risk of performance deterioration due to temperature fluctuations.
The crystal structure of this compound also has characteristics. Regularly arranged molecules form an ordered lattice, which affects its physical properties. For example, the way of crystal stacking and the interaction between molecules will have subtle effects on its optical, electrical and other properties. By adjusting external conditions or introducing substituents, the crystal structure can be regulated, and then its physical properties can be optimized, providing more possibilities for material design and application.
What are the chemical properties of 3,4-benzoquinoline?
The light of 3,2,4-thiadiazole-pyridine has unique chemical properties and multiple wonderful properties. In this compound, thiadiazole and pyridine combine, and the structure is exquisite, resulting in its specific properties.
In terms of stability, the heterocyclic ring formed by nitrogen and sulfur atoms in its structure gives it considerable stability. Nitrogen and sulfur atoms participate in the construction of the conjugate system with their lone pairs of electrons, making the electron cloud uniformly distributed and the molecular skeleton stable. Under normal conditions, it is not easy to decompose and isomerize.
In terms of reactivity, the carbon atoms around thiadiazole and pyridine rings change in charge density due to the electronic effect of heteroatoms. The nitrogen atom of the pyridine ring has electron-absorbing properties, which decreases the electron cloud density of the adjacent and para-site carbon atoms, and the electrophilic substitution reaction activity is relatively high at the meta-site; the sulfur and nitrogen atoms in the thiadiazole ring also affect the electron cloud of the surrounding atoms, causing them to react with a variety of nucleophiles and electrophilic reagents. If it is with halogenated hydrocarbons, nucleophilic substitution can occur under appropriate conditions, and alkyl groups such as alkyl groups can be introduced at specific positions of the thiadiazole or pyridine ring.
Spectral properties are also interesting. Due to the existence of a conjugate system, it has characteristic absorption in the ultraviolet-visible region. The higher the degree of conjugation, the longer the absorption wavelength. According to this characteristic, it can be qualitatively And the polar groups in its structure make it have corresponding characteristic absorption peaks in the infrared spectrum, which can help to determine the functional groups and analyze the molecular structure.
In terms of solubility, due to the polar heteroatoms containing nitrogen and sulfur, it has a certain solubility in polar organic solvents such as methanol, ethanol, and dimethyl sulfoxide, but it has a low solubility in non-polar solvents such as n-hexane and benzene. This difference in solubility is crucial in its separation, purification, and solvent selection.
What are the synthesis methods of 3,4-benzoquinoline?
3,4-Thiopyridine compounds have attracted much attention in the field of organic synthesis, and their synthesis methods are diverse. The following are detailed for you:
###1. Method of using sulfur-containing compounds and pyridine derivatives as raw materials
Select appropriate sulfur-containing reagents, such as mercaptan, thioether, etc., to react with pyridine derivatives under specific conditions. For example, a certain mercaptan and a specific pyridine halogen can undergo nucleophilic substitution in an alkali-catalyzed environment. Potassium carbonate can be used as a base, and N, N-dimethylformamide (DMF) is commonly used as a reaction solvent. During the reaction, the alkali captures the protons of the thiol, and the generated sulfur negative ions launch a nucleophilic attack on the check point of the halogen atom of the pyridine halogen, and the halogen atom leaves, thereby constructing a carbon-sulfur bond and initially forming a thiopyridine skeleton. Subsequent steps such as oxidation and reduction may need to adjust the functional group to obtain the target product. This method is relatively easy to find raw materials, and the reaction conditions are not harsh. It is more commonly used in the synthesis of 3,4-thiopyridine with simple structure.
##2. Cyclization condensation method
uses linear molecules with suitable functional groups to construct the thiopyridine structure through intramolecular cyclization and condensation reaction. For example, a compound containing amino, carbonyl and sulfur atoms is used as the starting material. Under the catalysis of acid or base, the amino and carbonyl groups first undergo condensation reaction to form imine intermediates, and then the imines and sulfur-containing groups are cyclized through processes such as nucleophilic addition in molecules, and finally the thiopyridine ring is formed. If the reaction system is acidic, a catalyst such as p-toluenesulfonic acid can be selected, and the reaction solvent can be selected as toluene. The water generated by the reaction is removed through a water separator to promote the forward reaction. This method can construct complex ring systems in one step, which is advantageous for the synthesis of 3,4-thiopyridine compounds with specific substituent distributions.
###3. Transition metal catalysis
With the help of transition metal catalysts, such as palladium, copper, etc., the formation of carbon-sulfur bonds and carbon-nitrogen bonds is realized, and then 3,4-thiopyridine is synthesized. Taking palladium catalysis as an example, a halopyridine-containing substrate, a sulfur-containing ligand and a base are mixed in a suitable solvent, and a palladium catalyst is added. Palladium first complexes with ligands to enhance its catalytic activity. After that, palladium and halopyridine undergo oxidative addition reaction, and the resulting palladium-carbon intermediate is then transmetallized with a sulfur-containing reagent. Finally, a carbon-sulfur bond is formed through reduction and elimination steps to construct a thiopyridine structure. This method has high reaction efficiency and good selectivity, and is especially suitable for the synthesis of 3,4-thiopyridine compounds with complex structures and high purity requirements, but the catalyst cost is relatively high.
What are the precautions for using 3,4-benzoquinoline?
During the use of 3,4-quinopyridine light, be sure to pay attention to the following things:
First, store away from light. This light-sensitive characteristic is quite strong, and exposure to strong light may cause its properties to mutate and its activity to decay. Therefore, when stored in a dark place, and the container should be made of a light-proof material to prevent light intrusion and maintain its chemical stability.
Second, control the temperature. Temperature has a huge impact on it. High temperature can cause a sudden change in the reaction rate and even cause the decomposition of components. Therefore, it is appropriate to use and store it under normal temperature environments. If the ambient temperature is too high or too low, it may damage its efficacy. Before use, it is necessary to carefully check whether the ambient temperature is suitable.
Third, comprehensive protection. When operating, appropriate protective equipment must be worn, such as gloves, goggles, etc. Because of its irritation and potential harm, direct contact with the skin or into the eyes can cause discomfort and even damage. Comprehensive protection can ensure personal safety.
Fourth, accurate dosage. This light is critical in the dosage of the reaction, improper dosage, or poor reaction effect, or cause side reactions. Therefore, before use, it must be measured accurately according to the reaction requirements and relevant instructions, and must not be increased or decreased at will to achieve the best use effect.
Fifth, good ventilation. The use site should be well ventilated. Because of its volatile gas or irritation, it can be concentrated in a limited space for a long time, which is not good for human health. Good ventilation can disperse harmful gases in time to create a safe working environment.
With 3,4-quinopyridine light, everything is subtle, all related to effectiveness and safety, must be treated with caution, must not be negligent.