2 Benzylsulfanyl Pyridine 3 Carboxylic Acid
pyridine pyrrole pyrazine piperidine piperazine

2-(benzylsulfanyl)pyridine-3-carboxylic acid

    Specifications

    HS Code

    493892

    Chemical Formula C13H11NO2S
    Molar Mass 245.297 g/mol
    Appearance Solid (predicted, actual may vary)
    Solubility Solubility in organic solvents like DMSO, DMF; low solubility in water (predicted)
    Boiling Point Estimated boiling point based on similar structures (approximate value)
    Melting Point Melting point range (estimated from related compounds)
    Density Calculated density (approximate value for reference)
    Pka Acidic pKa value of carboxylic acid group (estimated)
    Logp Calculated logP value indicating lipophilicity
    Reactivity Reactive towards reagents that react with carboxylic acid and sulfur - containing groups

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    Frequently Asked Questions

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    What is the chemical structure of 2- (benzylthio) pyridine-3-carboxylic acid?
    (2 - (carboxyl) amino-3-hydroxypropionic acid), which is involved in the chemical structure of serine. Serine is a non-essential amino acid and is of great significance in many biological processes such as protein synthesis.
    In the chemical structure of serine, its main chain contains one amino group (-NH2O) and one carboxyl group (-COOH), which are connected to the central α-carbon atom. This α-carbon atom is still connected to a hydrogen atom and a special side chain. The special feature of serine is that its side chain contains one hydroxy group (-OH), which is located above the β-carbon atom. This side chain structure gives serine unique chemical properties and biological functions. < Br >
    Hydroxyl groups are hydrophilic, making serine soluble in water, and can participate in the formation of hydrogen bonds inside or on the surface of proteins. Hydrogen bonds are crucial for stabilizing the three-dimensional structure of proteins, helping proteins maintain specific folded morphologies to perform their biological functions. In addition, hydroxyl groups are chemically active and can play an important role in enzyme-catalyzed reactions. As nucleophiles, they participate in many biochemical reactions, such as phosphorylation reactions. In this reaction, hydroxyl groups can accept phosphate groups to realize protein phosphorylation modification, which is of great significance for the regulation of cell processes such as cell signaling and metabolic regulation.
    Furthermore, serine has various metabolic pathways in the body. It can be converted into other amino acids by transamination, and also participates in one-carbon unit metabolism, providing important raw materials for nucleic acid and methionine synthesis in vivo, which is indispensable for cell proliferation, repair and maintenance of normal physiological functions.
    What are the main uses of 2- (benzylthio) pyridine-3-carboxylic acids?
    (Saltpeter) amino-3-carboxylic acid, its main uses have many aspects.
    In the field of gunpowder, this compound plays a key role. The characteristics of saltpeter can make this substance a high-quality gunpowder ingredient. It can release a lot of energy rapidly when burning, providing the power required for gunpowder explosion. In ancient military fields, whether it is the production of artillery ammunition or gunpowder used in various types of fire attack equipment, (saltpeter) amino-3-carboxylic acid is integrated into it in a reasonable ratio, which greatly enhances the lethality and destructive power of weapons.
    In the field of medical pharmaceuticals, it also has important functions. Due to its special chemical structure, it shows potential efficacy in the treatment of certain diseases. Doctors can use its characteristics to develop drugs for specific diseases. For example, after refining and processing, it is made into an internal medicine, which is used to regulate human physiology, and can relieve and treat some inflammatory or metabolic disorders in the body.
    In the field of agricultural fertilizers, (saltpeter-based) amino-3-carboxylic acid can play a positive role. It contains nitrogen, phosphorus and other elements necessary for plant growth. After being applied to the soil, it can effectively improve soil fertility and provide sufficient nutrients for plant growth. After plants absorb these nutrients, they can promote root development, enhance photosynthesis, and then improve crop yield and quality, and help agricultural harvest.
    What are the synthesis methods of 2- (benzylthio) pyridine-3-carboxylic acids?
    In order to prepare di- (hydroxyphenyl) propionic acid-3-benzyl ester, the method of synthesis has been studied by Sanda in the past, and now I will describe it in detail.
    One method is to use a suitable phenolic compound as the starting material, and first introduce a hydroxyl protecting group to avoid the interference of the hydroxyl group during the reaction. Subsequently, the acyl group is introduced at a specific position of the phenol ring through the Fu-Ke acylation reaction to form the key intermediate. This step requires careful control of the reaction conditions, such as temperature, catalyst dosage, etc., to ensure the precise location and yield of acylation. Then, the obtained intermediate is nucleophilic substitution with the benzyl-containing halogen to construct the benzyl ester structure. Finally, the hydroxyl protecting group is removed to obtain the target product.
    Another method is to first react phenol with a suitable acid anhydride to form an ester derivative. After a specific rearrangement reaction, the molecular structure is rearranged to form an intermediate containing the desired carbon-carbon bond. Next, the functional groups of the intermediate are adjusted by reduction reaction to prepare for the introduction of benzyl esters. Subsequently, benzyl esters are formed by reacting with benzyl halide, and finally the product is purified after appropriate reprocessing to obtain a pure bis- (hydroxyphenyl) propionic acid-3-benzyl ester.
    In addition, there are strategies for constructing target molecules through multi-step reactions using other compounds with specific structures as starting materials. First, the core skeleton is formed by cyclization reaction, and then the functional groups on the skeleton are modified and transformed, and functional groups such as hydroxyl groups, carboxyl groups and benzyl esters are gradually introduced. In this process, appropriate reagents and conditions need to be selected according to the characteristics of each step of the reaction to ensure the smooth progress of each step of the reaction and the purity of the product.
    There are various methods for synthesizing di- (hydroxyphenyl) propionic acid-3-benzyl ester. Each method has its own advantages and disadvantages. It is necessary to carefully choose the appropriate synthesis path according to the actual situation, such as the availability of raw materials, the difficulty of the reaction, and the purity requirements of the product.
    What are the physical properties of 2- (benzylthio) pyridine-3-carboxylic acids?
    The (carboxyl) amino group and its (carboxyl) derivatives are very important parts of organic chemistry, and their physical properties are unique. They are described as follows:
    - ** state **: Such compounds are in different states at room temperature and pressure. Simple ones, such as amino acids, are mostly crystalline solids. Due to the interaction of hydrogen bonds between molecules, the structure is arranged in an orderly manner. Some compounds containing amino and carboxyl groups in small molecules, such as aminoacetic acid, are relatively small in molecular weight, weak in intermolecular forces, or in a liquid state.
    - ** Solubility **: Good water solubility. Because both amino and carboxyl groups in the molecule are polar, they can form hydrogen bonds with water molecules. For example, common amino acids have good solubility in water, which is convenient for participating in various biochemical reactions in organisms. However, with the increase of hydrophobic groups in the molecule, its solubility in water decreases, while its solubility in organic solvents may increase.
    - ** Melting Point and Boiling Point **: Generally speaking, the melting point is relatively high. This is due to the interaction between hydrogen bonds and electrostatic electricity between molecules, which makes the molecules tightly bound. It takes more energy to destroy the lattice structure and cause the melting point to increase. The boiling point is also higher, because the gasification process needs to overcome the strong interaction force between molecules.
    - ** Odor **: Some compounds containing amino groups and carboxyl groups have a special odor. For example, some amino acids or their derivatives may have a weak ammonia smell, which is due to the presence of amino groups; some have a weak sour taste, which is derived from carboxyl groups.
    - ** Density **: Density is often related to molecular structure and relative molecular mass. Those with large relative molecular mass and compact structure have relatively large density; those with loose structure have low density.
    In short, the physical properties of (carboxyl) amino groups and their (carboxyl) derivatives are significantly affected by molecular structure, hydrogen bonds and other intermolecular forces, which are of great significance in organic synthesis, biochemistry and other fields.
    What is the market price of 2- (benzylthio) pyridine-3-carboxylic acid?
    In today's market, the prices of (zirconium-titanium-based) tantalum and antimony trioxide are variable and capricious, depending on supply and demand, cost, and political regulations.
    Let's talk about zirconium-titanium-based tantalum first. It is important in aerospace, electronics, and chemical industries, with wide uses and strong demand. On the supply side, the source of minerals, mining techniques, and international trade can all be controlled. If the ore source is abundant and the mining and smelting are smooth, the supply is sufficient, and the price is stable; however, if the ore source is rare, the mining and smelting are difficult, or the trade changes, the supply is shrinking and the price rises. In recent years, with the rapid progress of science and technology, the electronics and aerospace industries are booming, and the demand for zirconium-titanium-based tan The control of mineral sources and the difficulty of mining make the growth rate of supply slower than demand, which is an upward trend in price. However, the market situation changes, the guidance of political regulations and the emergence of new technologies can make its price fluctuate.
    As for antimony trioxide, which is mostly a raw material for flame retardants, it is indispensable in plastics, textiles, electronic appliances and other industries. The change in its price is also related to supply and demand. From the supply side, the storage and production of antimony ore, as well as the production capacity of smelters, are the key. The global antimony ore resources are limited, and some production areas may shrink due to environmental regulations and resource exhaustion. On the demand side, with the steady increase in the demand for flame retardant in various industries, especially the expansion of the electronic appliances and building materials industries, the demand for antimony trioxide is also long. Recently, due to stricter environmental protection, some small smelters have been shut down, and the supply end has been under pressure; while the demand end has remained strong, the price has risen.
    In summary, the market prices of zirconium-titanium-based tantalum and antimony trioxide often change due to supply and demand, policies, costs, technological innovation, etc. Market entrants should consider the situation, pay attention to changes in market conditions, and respond to changes in price.