Products

4-Chloro-3-(3-Methyl-5-Oxo-4,5-Dihydro-1H-Pyrazol-1-Yl)Benzenesulfonic Acid

Lingxian Chemical

Specifications

HS Code

925520

Chemical Formula C10H9ClN2O5S
Molar Mass 304.71 g/mol
Appearance Solid (usually white or off - white)
Solubility In Water Moderate to low (sulfonic acid group increases solubility to some extent but other groups limit it)
Melting Point Specific value would require experimental determination, but likely in the range where organic solids with similar structures melt, around 150 - 250°C approximately
Boiling Point Decomposes before boiling due to the presence of sensitive functional groups
Pka Of Sulfonic Acid Group Typically around -1 to 1 (sulfonic acids are strong acids)
Density Estimated density around 1.5 - 1.7 g/cm³ based on similar organic sulfonic acid compounds
Uv Vis Absorption Absorption peaks likely in the UV region due to the presence of aromatic rings, around 200 - 300 nm
Ir Absorption Characteristic peaks for C=O (carbonyl) around 1700 - 1750 cm⁻¹, N - H around 3200 - 3500 cm⁻¹, S=O around 1000 - 1300 cm⁻¹, C - Cl around 600 - 800 cm⁻¹
Packing & Storage
Packing 100 - gram pack of 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4,5 - Dihydro - 1H - Pyrazol - 1 - Yl) Benzenesulfonic Acid in sealed container.
Storage 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4,5 - Dihydro - 1H - Pyrazol - 1 - Yl)Benzenesulfonic Acid should be stored in a cool, dry place. Keep it in a tightly - sealed container to prevent moisture absorption and exposure to air, which could potentially degrade the chemical. Avoid storing near heat sources or flammable materials, and ensure proper labeling for easy identification.
Shipping 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4,5 - Dihydro - 1H - Pyrazol - 1 - Yl)Benzenesulfonic Acid will be shipped in sealed, corrosion - resistant containers, following strict chemical transport regulations, to ensure safety during transit.
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4-Chloro-3-(3-Methyl-5-Oxo-4,5-Dihydro-1H-Pyrazol-1-Yl)Benzenesulfonic Acid
General Information
Historical Development
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, one of the chemical substances. The first appearance of its substance originated from the research and exploration of various sages. At that time, everyone was committed to the discovery of new substances. After years of hard thinking and repeated trials, this quality was obtained.
At the beginning, the preparation was difficult and the yield was not abundant, but the public was not discouraged. With the passage of time, the technology has become more and more refined, and the method has been improved one after another. Later scholars, on the basis of predecessors, dug deep into the mechanism and optimized the steps, so that the yield of this product gradually increased and the purity also increased. In today's world, this chemical product has been used in many fields, either as the cornerstone of medical research and development, or helpful in material creation. Its historical evolution depends on the unremitting efforts of chemical researchers of successive generations to achieve today's prosperity.
Product Overview
Today there is a substance called 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid. This substance has a specific chemical structure, the chlorine atom is connected to the benzene ring, and the pyrazolyl is also connected to the benzene ring, and has a sulfonic acid group. It may have unique uses in the field of chemical research. Or it can be used as a key intermediate in organic synthesis. With its structural properties, it can participate in a variety of chemical reactions to achieve ingenious construction of molecular structures. Or in material science, because of its special chemical properties, the properties of materials have been improved. Although its application remains to be further explored, it has already revealed its unique potential, opening up new avenues for chemical research, and is expected to shine in many fields in the future.
Physical & Chemical Properties
The physicochemical properties of 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid are important to our research. Looking at its properties, or showing a specific color state, it is related to the appearance of the appearance. It needs to be investigated in detail at the beginning of the study. Its solubility varies among various solvents, or it is easily soluble, or slightly soluble, which has a great influence on the separation and purification steps.
When it comes to chemical properties, it contains functional groups such as chlorine and sulfonic acid groups, and its chemical activity is significant. The structure of pyrazolyl allows it to participate in many reactions under specific conditions. Stability is also an important consideration. In different temperatures and pH environments, it may remain stable or prone to change. This requires in-depth investigation to clarify its characteristics in different scenarios and lay the foundation for subsequent applications.
Technical Specifications & Labeling
For 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, its technical regulations and identification (commodity parameters) are the key. Looking at this compound, in order to clarify its technical regulations, it is necessary to study the synthesis method in detail. The first choice of raw materials must be carefully selected to ensure that the purity is up to standard. During the synthesis process, the reaction conditions must be precisely controlled, such as temperature, pressure, reaction time, etc., there is a slight difference, or the product is impure.
As for the label, the commodity parameters should be listed in detail. Its chemical structure needs to be accurately illustrated, and its physical properties such as melting point, boiling point, solubility, etc., should also be clearly marked. Key indicators such as purity and impurity content of this compound cannot be missed. In this way, others can understand the characteristics of this compound, and when using and researching, they can see it in detail and operate it without error to achieve the best effect.
Preparation Method
Now we want to make 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid. The method of preparation is to prepare all raw materials. Take an appropriate amount of chlorobenzenesulfonic acid, and 3-methyl-5-oxo-4,5-dihydro-1H-pyrazole, both of which are the main materials.
During the reaction process, place the two in a suitable container and control the temperature and pressure. At the beginning, the temperature rises slowly, until the reactant responds, seeing its color change and gas exit, it is known that it should begin. Continue to keep the temperature and pressure, so that the product should be completed. It should be completed, after separation and purification. Use a filter to remove its impurities, and then use distillation and extraction to refine its quality.
And set up a mechanism of checks and balances to check the speed and rate. If it should be too sick or too slow, adjust the temperature, pressure and amount of material, so that it should go smoothly, and finally get a pure product for other uses.
Chemical Reactions & Modifications
Wenfu 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4, 5 - Dihydro - 1H - Pyrazol - 1 - Yl) Benzenesulfonic Acid is related to chemical reactions and modifications. Our generation is a researcher of chemicals, and we often study the way substances change.
To observe this compound, if you want to understand its chemical reaction, you need to observe its structure and functional groups. Its reaction may also change due to substitution, addition, and elimination. When modifying, think about how to adjust its characteristics, or increase its stability, or enhance its activity.
In the reaction, the control of conditions is essential, and temperature, pressure, and catalyst can all affect the effect. The way of modification also depends on fine design to achieve the expected performance. Only by understanding the principles of chemistry and carefully practicing the method of experiment can we explore its mysteries, obtain the delicacy of reaction and modification, and contribute to the progress of chemistry.
Synonyms & Product Names
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, the synonym and trade name of this substance, is really related to the needs of our generation of chemical research. Its synonyms, either according to structural characterization or according to nature, are commonly recognized by the academic community. As for the trade name, it is used for the recognition of its characteristics and the identification of people in the city.
Considering the names of chemical substances in the past, at the beginning, it was mostly called according to its source and shape. Later, the theory gradually became clear, and the names were determined according to the structure and composition, so there was a system of names. However, inter-city trade, in order to facilitate circulation and increase its recognition, gave birth to the name of the commodity.
For our generation of chemical researchers, a detailed examination of synonyms and trade names shows that the names of this thing are similar and different in the academic and industrial circles. Second, when researching and applying, it will not be confused, and it can be used to identify the needs. It is really beneficial for the progress of chemistry.
Safety & Operational Standards
There is a chemical substance known as 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid. It is necessary to specify the safety and operation specifications of this substance.
Where the handling of this substance is involved, the operator must first understand its properties. This substance may have special chemical properties. When handling, the established laws should be strictly followed. When using it, it is advisable to use a special device to measure it accurately, and it must not be done arbitrarily, so as not to damage the quality and prevent accidents.
The method of storing it is also important. It must be placed in a dry, cool and well-ventilated place, away from fire and heat sources, to prevent its properties from changing and causing unexpected risks. And it needs to be separated from other things to avoid their interaction and harm.
During operation, protective gear is indispensable. In front of special clothes, wear goggles and gloves to prevent this object from touching the skin, eyes and eyes, and causing injuries to the body. If you accidentally touch it, rinse it with plenty of water as soon as possible and seek medical attention.
Furthermore, when discarding this object, do not dispose of it at will. When in accordance with environmental protection regulations, properly dispose of it to avoid pollution and the environment.
In general, the handling and safety of 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid must be handled with caution and follow the regulations to ensure safety.
Application Area
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, its application field is very critical. In the field of pharmaceutical research and development, or through subtle transformation, a drug with unique curative effect can be prepared to help physicians heal diseases. In the field of material science, or by virtue of its characteristics, it can participate in the synthesis of materials with special properties, so that materials can have different functions. In chemical production, it can also be a key raw material. Through multiple processes, a variety of chemical products can be produced, which are widely used in various fields to help the industry thrive, demonstrate its extraordinary value in many fields, and promote the continuous progress of related industries.
Research & Development
Modern chemistry has flourished, and all kinds of new substances have emerged one after another. I focus on the study of 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid.
At first, explore its structure, analyze the conformation of the molecule in detail, understand the relationship of each atom, and know the reason for its characteristics. Then, study the method of its synthesis, and after many attempts, adjust all kinds of conditions, and hope to obtain an efficient path. Although the process is difficult, setbacks are repeated, but never give up.
has been slightly successful now, and the synthesis method is gradually stabilizing. However, if you want to use it widely, you still need to improve. In the future, we should expand its application field, dig deep into the potential in medicine and materials, and hope to make innovations to promote the transformation of this product from research to practice, promote its development, and contribute to the progress of chemistry.
Toxicity Research
Taste the industry of chemical industry, there are many substances, and the study of toxicity is related to people's livelihood. Today there is a thing, named 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4, 5 - Dihydro - 1H - Pyrazol - 1 - Yl) Benzenesulfonic Acid.
The toxicity of this thing should be investigated in detail. Or consider its harm to life, in the animal body, observe its physiological changes, and observe the damage of organs. In the plant, it depends on its growth state, whether there is aberration and withering. It also needs to be investigated in the environment, whether it is in the water and soil, whether it is difficult to disappear, causing the ecological method.
The test of toxicity follows the scientific method and is rigorous. Only by getting the truth can we understand its advantages and disadvantages, so that this thing can be used properly in the world, avoid disasters and profit, protect the safety of all things, and promote the prosperity of chemical industry.
Future Prospects
I have tried to study chemical substances, and today I will talk about 4 - Chloro - 3 - (3 - Methyl - 5 - Oxo - 4,5 - Dihydro - 1H - Pyrazol - 1 - Yl) Benzenesulfonic Acid. Although it has various characteristics at the moment, there are still infinite possibilities for future development.
View its chemical properties, or it can shine on the road of new drug research and development. With its unique structure, it may be the foundation for a good drug for anti-disease. The progress of medicine often depends on the emergence of new substances. This substance may become the key to the innovation of medicine tomorrow.
Furthermore, in the field of materials science, it may help the creation of new materials. With its chemical activity, it may be able to change the quality of materials, making them more tough and durable. It is used in aerospace, electronics and other industries to promote its vigorous progress.
Although it is only a glimpse at the moment, I believe that with time, it will be able to show extraordinary power in the future, open up new horizons for the well-being of mankind, and this is my eagerness for its future.
Frequently Asked Questions
What are the chemical properties of 4-Chloro-3- (3-Methyl-5-Oxo-4, 5-Dihydro-1H-Pyrazol-1-Yl) Benzenesulfonic Acid
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, which is an organic compound. It has unique chemical properties. Looking at its structure, it is composed of benzenesulfonic acid group, chlorine atom and specific pyrazole ring structure.
Among this compound, benzenesulfonic acid group gives it a certain acidic property. Sulfonic acid group (-SO-H) is easy to dissociate hydrogen ions, so it can exhibit acidic properties under suitable conditions, and can neutralize with bases to form corresponding salts. This acidic property may play a key role in many chemical reactions and applications, such as in some catalytic reactions. The presence of chlorine atoms adds unique chemical activity to the compound. Chlorine atoms have high electronegativity, which can change the electron cloud distribution of molecules, thereby affecting their reactivity and selectivity. In nucleophilic substitution reactions, chlorine atoms can act as leaving groups to react with nucleophiles and introduce other functional groups to achieve structural modification and transformation of compounds.
And 3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl moiety, the pyrazole ring structure has a certain conjugate system, which endows the molecule with certain stability and special electronic effects. The substituents on the ring, such as methyl and carbonyl, further affect the physical and chemical properties of the molecule. Methyl is the power supply group, which can change the electron cloud density of the pyrazole ring and affect its reactivity; carbonyl has strong electron absorption, which not only affects the electron distribution of the pyrazole ring, but also may participate in various chemical reactions, such as nucleophilic addition reactions.
Overall, 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid exhibits diverse chemical properties due to the synergistic effect of various parts of the structure, and may have potential applications and research values in organic synthesis, medicinal chemistry and other fields.
What are the main uses of 4-Chloro-3- (3-Methyl-5-Oxo-4, 5-Dihydro-1H-Pyrazol-1-Yl) Benzenesulfonic Acid
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid has a wide range of uses. In the field of medicinal chemistry, it can be a key intermediate for the creation of new drugs. Through delicate chemical reactions, it can be ingeniously converted into compounds with specific pharmacological activities, or can be used to fight specific diseases, such as inflammation, tumors, etc., to contribute to human health and well-being.
In the field of materials science, this substance also has its uses. Due to its special molecular structure, it may endow materials with unique properties. For example, in the preparation of some functional polymer materials, the addition of this substance may improve the stability, solubility or optical properties of the material, and then expand the application of the material in many fields such as electronics and optics.
In agricultural chemistry, its role should not be underestimated. Or it can be used as an important raw material for the synthesis of new pesticides. Through rational molecular design and synthesis, pesticide products with efficient control of crop diseases and pests can be created, and the impact on the environment is small, which contributes to the sustainable development of agriculture.
In the field of organic synthetic chemistry, it is often regarded as an important starting material or intermediate. With its lively reaction check point, chemists can follow ingenious synthesis routes to construct complex and diverse organic compounds, injecting new vitality into the development of organic synthetic chemistry and promoting the field to new heights.
What is the synthesis method of 4-Chloro-3- (3-Methyl-5-Oxo-4, 5-Dihydro-1H-Pyrazol-1-Yl) Benzenesulfonic Acid
To prepare 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid, the method is as follows:
First, the corresponding starting materials need to be prepared, such as chlorine-containing benzenesulfonic acid derivatives and specific pyrazole derivatives. These two are the key substrates for synthesis, and their purity and quality depend on the quality of the product.
The reaction is often carried out in suitable solvents, such as polar organic solvents, such as N, N-dimethylformamide (DMF) or dimethyl sulfoxide (DMSO). Such solvents can effectively dissolve the substrate and promote the smooth occurrence of the reaction.
In order to make the reaction efficient, a catalyst is often introduced. Base catalysts are more commonly used, such as potassium carbonate, sodium carbonate, etc. Bases can help the nitrogen atom of pyrazole derivatives deprotonate, enhance their nucleophilicity, and then undergo nucleophilic substitution reaction with benzenesulfonic acid derivatives.
During the reaction, precise temperature control is also important. Depending on the reaction process, the initial temperature may need to be heated to a certain extent to start the reaction, which is usually controlled between 50-100 ° C. When the reaction is started, the temperature can be adjusted appropriately according to the situation to ensure the smooth progress of the reaction and avoid side reactions. During the
reaction, use thin layer chromatography (TLC) or high performance liquid chromatography (HPLC) and other monitoring methods to observe substrate consumption and product formation. When the substrate is almost exhausted and the product reaches the expected ratio, the reaction can be terminated.
After the reaction is completed, the post-treatment steps are carried out. The reaction solution is usually diluted with water first, followed by organic solvent extraction. The difference in solubility of the product and impurities in different solvents is used to achieve preliminary separation. After purification by column chromatography or recrystallization, high purity 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid is obtained. Column chromatography can separate the product with a suitable eluent according to the polarity difference between the product and the impurity; recrystallization can obtain a pure crystalline product by the change of the solubility of the product in a specific solvent at different temperatures.
What is the price range of 4-Chloro-3- (3-Methyl-5-Oxo-4, 5-Dihydro-1H-Pyrazol-1-Yl) Benzenesulfonic Acid in the market?
I don't know the price range of 4-chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid in the market. The price of this compound often changes due to various reasons. First, the price varies depending on the manufacturer. Large manufacturers may have high prices due to their excellent craftsmanship and high quality; small factories may have slightly lower prices. Second, the purchase quantity is also a major factor. If you buy in bulk, merchants may have discounts and lower unit prices; if you buy in small quantities, the price may be higher. Third, the market supply and demand situation has a great impact. If the demand is large, the supply is small, the price will rise; if the supply exceeds the demand, the price may drop. Fourth, the cost of raw materials, transportation costs, etc. also affect the price. Raw materials are expensive, transportation is far and expensive, and the price will also rise. Because there is no specific market survey and related data, it is difficult to determine its price range.
What are the safety and precautions of 4-Chloro-3- (3-Methyl-5-Oxo-4, 5-Dihydro-1H-Pyrazol-1-Yl) Benzenesulfonic Acid
4-Chloro-3- (3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-yl) benzenesulfonic acid is a matter of safety and should be examined in detail.
In terms of its toxicity, although there is no conclusive conclusion of extreme toxicity, it may have certain effects on the organism in experiments. If it accidentally touches the skin, it may cause local discomfort, such as redness and itching. Once in the eyes, due to its chemical properties, it will irritate the eyes or damage vision, so when in contact, be sure to take comprehensive protection.
Furthermore, this substance also has potential effects in the environment. Although it is difficult to determine whether it can degrade rapidly, it will survive for a long time, or affect the surrounding ecology. If it enters the water source, the aquatic organisms may be harmed and the ecological balance may be destroyed.
When using, many precautions need to be kept in mind. Operators must wear professional protective clothing, such as protective clothing and protective gloves, which are the key to preventing skin contact. Eye protection is also indispensable, and goggles should be worn properly. Operate in a well-ventilated place to prevent the accumulation of harmful gases. After use, properly dispose of the remaining materials. Do not discard them at will. It should be handled in an environmentally friendly and safe manner in accordance with relevant regulations. The equipment used also needs to be carefully cleaned to prevent accidents caused by residual substances. Only in this way can we ensure the safety of the use process and avoid disasters.