Tert Butyl 3 6 Dihydropyridine 1 2h Carboxylate
pyridine pyrrole pyrazine piperidine piperazine

tert-butyl 3,6-dihydropyridine-1(2H)-carboxylate

    Specifications

    HS Code

    990287

    Chemical Formula C10H17NO2
    Molar Mass 183.247 g/mol
    Appearance Typically a colorless to pale - yellow liquid or solid
    Boiling Point Approximately 230 - 240 °C (estimated, can vary with purity)
    Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, ethyl acetate
    Solubility In Water Insoluble or sparingly soluble
    Flash Point To be determined experimentally, but likely in the flammable liquid range
    Density Estimated around 1.0 - 1.1 g/cm³ (approximate, based on similar compounds)
    Stability Stable under normal conditions, but may react with strong oxidizing agents

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    Frequently Asked Questions

    As a leading tert-butyl 3,6-dihydropyridine-1(2H)-carboxylate supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

    What are the chemical properties of tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate?
    Tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylic acid ester, this is an organic compound. It has unique chemical properties, so let me tell you one by one.
    In terms of stability, this compound contains tert-butyl and pyridine ring structures. Tert-butyl is a large substituent, which can enhance molecular stability through the steric hindrance effect. Pyridine rings are aromatic and have a special electron cloud distribution, which also helps to improve the overall stability, making them stable under conventional conditions and not easy to decompose spontaneously.
    In terms of solubility, since tert-butyl is a hydrophobic group, while pyridine rings and ester groups have certain polarities. This compound should have good solubility in non-polar organic solvents such as toluene and dichloromethane. Due to the principle of similar miscibility, non-polar solvents and hydrophobic tert-butyl groups are compatible with each other. However, its solubility in water is poor, because its hydrophobic part accounts for a large proportion, it is difficult to form effective interactions with water molecules.
    In terms of chemical activity, ester groups are the key activity check points of this compound. It can undergo hydrolysis reaction. Under acidic or alkaline conditions, ester bonds are broken to form corresponding carboxylic acids and alcohols. In alkaline environments, the hydrolysis rate is usually faster, because hydroxide ions can effectively attack ester carbonyl carbons. The nitrogen atom of the pyridine ring has a lone pair of electrons and is alkaline to a certain extent, which can react with acids to form salts, which makes the compound able to participate in specific acid-base related reactions. In addition, the 3,6-dihydropyridine part contains unsaturated bonds, which can undergo addition reactions, such as addition with halogens, hydrogen halides and other electrophilic reagents, thereby introducing new functional groups and expanding their chemical derivatization capabilities.
    What are the preparation methods of tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate
    The methods for preparing tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylic acid esters vary widely, and the following are common ones:
    First, react with carboxyl-containing compounds with suitable nitrogen-containing heterocyclic precursors. Commonly selected pyridine derivatives are the starting materials. Through specific reaction conditions, their structure is changed, and tert-butoxycarbonyl is introduced to construct the structure of the target product. During the reaction, conditions such as solvent, base and reaction temperature should be carefully selected. For example, polar aprotic solvents such as N, N-dimethylformamide (DMF) are selected, which can effectively dissolve the reactants and promote the reaction process. Using weak bases such as potassium carbonate as acid binding agents, the auxiliary reaction proceeds smoothly. The temperature is controlled in a suitable range, because the temperature is too high or side reactions will breed, and if it is too low, the reaction rate will be slow.
    Second, the reaction with the help of organometallic reagents. Intermediates containing metal active centers can be prepared first, which interact with the corresponding halogenated pyridine derivatives and tert-butyl carboxylic acid derivatives. In this process, the activity and selectivity of organometallic reagents are crucial. For example, using Grignard reagents or lithium reagents, they can undergo nucleophilic substitution with halogenates and then carboxylation with tert-butyl carboxylic acid derivatives. However, such reactions require harsh reaction environments and require anhydrous and anaerobic reagents to avoid deactivation of reagents.
    Third, a multi-step tandem reaction strategy is adopted. The basic skeleton of the pyridine ring is first constructed through a series of reactions, and then tert-butoxycarbonyl is introduced in specific steps. This approach can make full use of the characteristics of each step of the reaction to precisely regulate the structure of the product. However, the multi-step reaction also has drawbacks. The complicated steps can easily reduce the yield of the product, and each step needs to be properly separated and purified to remove impurities and ensure the smooth subsequent reaction.
    There are various methods for preparing tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylic acid esters, each with its own advantages and disadvantages. Experimenters should carefully select the appropriate method according to their own needs, raw material availability and reaction conditions to achieve the best preparation effect.
    In which fields is tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate used?
    Tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate is important in organic synthesis, medicinal chemistry, materials science and other fields.
    In the field of organic synthesis, it is often a key intermediary. Its structure is unique, and the presence of the pyridine ring endows it with certain stability and reactivity. With this, a variety of chemical reactions, such as nucleophilic substitution and addition, can be used to construct more complex organic molecular structures. Chemists use this to expand the diversity of molecules and pave the way for the synthesis of new organic compounds.
    In the field of medicinal chemistry, this compound has also attracted considerable attention. Because pyridine structures are commonly found in many drug molecules, they have a wide range of biological activities. Tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate may be used as the core structure of the lead compound. After modification and optimization, it is expected to develop drugs for specific diseases. For example, its substituents may be adjusted to change its interaction with biological targets, thereby improving the efficacy and reducing side effects.
    In the field of materials science, it may be involved in the synthesis of polymer materials. Because its structure contains both rigid pyridine rings and flexible tert-butyl and ester groups, it can affect the physical and chemical properties of materials. Using this as a monomer or crosslinking agent, materials with special properties, such as good mechanical properties, thermal stability or optical properties, can be prepared for use in optical devices, high-performance polymer materials, etc.
    In summary, tert-butyl 3,6-dihydropyridine-1 (2H) -formate has shown broad application prospects in many fields due to its unique structure, and is indeed a valuable compound in chemical research and industrial production.
    What is the market outlook for tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate?
    Tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate is one of the organic compounds. In the current chemical and pharmaceutical fields, its market prospects are unique.
    Looking at the chemical industry, this compound is often used as a key intermediate. Due to its unique chemical structure and reactivity, it can participate in a variety of organic synthesis reactions and help build complex molecular structures. Nowadays, the chemical industry has an increasing demand for novel and efficient synthesis paths. Tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate may emerge in the research and development of new materials and the preparation of fine chemicals due to its characteristics. With the rapid development of materials science, the demand for high-performance and special functional materials continues to rise, and this compound is expected to provide an opportunity for related synthesis. Therefore, it may welcome growth in the chemical market.
    In the field of medicine, this compound has also attracted attention. Many studies have shown that compounds containing pyridine structures are often biologically active and can be used as lead compounds in drug development. The structure of tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate may endow it with potential pharmacological activities, such as anti-inflammatory, anti-tumor, etc. The current competition in the research and development of innovative drugs is fierce, and researchers are actively looking for unique active structural units. If we can further explore, modify and modify on the basis of this compound, innovative drugs may be developed. In the pharmaceutical market, it may have broad development space as a potential drug intermediate.
    However, its market development also faces challenges. The synthesis process needs to be optimized and improved to increase yield, reduce costs, and enhance market competitiveness. And its safety and environmental impact need to be deeply studied, in line with the concept of green chemistry and sustainable development. In this way, tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate can move forward steadily in the market and unlock greater potential.
    What is the safety of tert-butyl 3,6-dihydropyridine-1 (2H) -carboxylate
    Futert - butyl 3,6 - dihydropyridine - 1 (2H) -carboxylate, organic compounds are also. The consideration of its safety involves many ends.
    When it comes to physical properties, the state, taste and color of this substance at room temperature are all related to safety. If it is a volatile body, it can spread in the air, or cause inhalation risk, irritating the respiratory tract; if there is a special smell, it is strongly pungent, and it also warns of potential hazards.
    Chemical activity is also critical. It is reactive, and it may react violently when exposed to specific reagents and conditions. In case of strong acids, strong bases, or cause decomposition, exotherm, or even explosion, it threatens the safety of operation.
    Toxicological properties cannot be ignored. Oral, percutaneous, and inhalation toxicity all need to be studied. If it has high oral toxicity, accidental ingestion will damage the body, damage the digestive system, and organ functions; percutaneous contact may cause skin irritation, allergies, redness, swelling, and itching; if inhalation causes respiratory damage and systemic toxicity, it poses a great threat in the production and use environment.
    Environmental impact is also a safety category. How degradable is this substance when discharged into the environment? If it is difficult to degrade, or accumulates in the ecology, it endangers organisms. Its impact on water ecology and soil organisms is related to ecological safety.
    In the place of production, storage, and use, fire prevention, explosion prevention, ventilation, and other measures need to be adapted. During operation, personal protective equipment, such as gloves, masks, and goggles, is essential to ensure safety.