Tert Butyl 2h Pyrrole 1 5h Carboxylate
pyridine pyrrole pyrazine piperidine piperazine

tert-butyl-2H-pyrrole-1(5H)-carboxylate

    Specifications

    HS Code

    871368

    Chemical Formula C10H15NO2
    Molecular Weight 181.23 g/mol

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    General Information
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    Frequently Asked Questions

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    What is the chemical structure of tert - butyl - 2H - pyrrole - 1 (5H) -carboxylate?
    Alas! Now there is "tert-butyl-2H-pyrrole-1 (5H) -carboxylate" to clarify its chemical structure. This is the name of organic chemistry.
    "tert-butyl" is tert-butyl. Its structure is one carbon atom connected to three methyl groups, in the shape of a trident, stable and specific steric resistance. Tert-butyl is in organic molecules and often affects the physical and chemical properties of molecules, such as solubility and reactivity.
    "pyrrole" is a pyrrole, a five-element nitrogen-containing heterocyclic compound. Its ring is composed of four carbon atoms and one nitrogen atom, and is aromatic. The hydrogen atom on the pyrrole ring can be substituted to derive a variety of compounds.
    In "2H-pyrrole-1 (5H) -carboxylate", "2H" and "5H" indicate the location of the hydrogen atom. "Carboxylate" is a carboxylate group, indicating that the pyrrole ring is connected with a carboxylate structure. Presumably a specific position (according to the naming convention) of the pyrrole ring is connected to the carboxylate group.
    In summary, the chemical structure of "tert-butyl-2H-pyrrole-1 (5H) -carboxylate" is that the tert-butyl group is connected to the pyrrole ring modified at a specific position (2H-1 (5H)), and the pyrrole ring is related to the carboxylate group. This structure integrates the spatial characteristics of tert-butyl, the aromaticity of pyrrole ring and the reactivity of carboxylate, and may have unique uses in organic synthesis, pharmaceutical chemistry and other fields.
    What are the main uses of tert - butyl - 2H - pyrrole - 1 (5H) -carboxylate?
    Tert-butyl-2H-pyrrole-1 (5H) -carboxylic acid esters have a wide range of uses in the field of organic synthesis. First, it is often a key building block for the construction of complex nitrogen-containing heterocyclic compounds. Due to its unique structure, with the activity check point of pyrrole ring and the specific properties of tert-butyl, it can gradually build a complex cyclic structure by a variety of chemical reactions, such as nucleophilic substitution, cyclization, etc., and interact with various reagents, which is of great significance in pharmaceutical chemistry and total synthesis of natural products.
    Furthermore, in the process of drug development, this compound may be used as a structural unit of a lead compound. Pyrrole rings widely exist in many biologically active natural products and synthetic drug molecules. The introduction of tert-butyl can adjust the lipid solubility and steric resistance of molecules, and affect their binding mode with biological targets, thereby optimizing the activity, selectivity and pharmacokinetic properties of drugs. When developing new anti-cancer, anti-infection and other drugs, or modifying their structures, in order to find new drugs with high efficiency and low toxicity.
    In addition, in the field of materials science, it also has potential applications. Due to its specific chemical structure, or through polymerization, the main chain or side chain of polymer materials can be introduced to endow the materials with special photoelectric properties and thermal stability. Polymer materials with fluorescent properties are synthesized for optical sensors, Light Emitting Diodes and other devices.
    In short, tert-butyl-2H-pyrrole-1 (5H) -carboxylic acid esters are valuable compounds in organic synthesis, drug development, materials science and other fields due to their unique structure and reactivity. It has broad application prospects and is necessary for in-depth research.
    What are the synthesis methods of tert - butyl - 2H - pyrrole - 1 (5H) -carboxylate?
    The method of synthesizing tert-butyl-2H-pyrrole-1 (5H) -carboxylate has been explored by chemists throughout the ages, and there are many methods.
    First, using pyrrole as the starting material, in a suitable reaction vessel, add an appropriate amount of base to form pyrrole negative ions to enhance its nucleophilicity. Then add tert-butyl halocarboxylate, at a mild temperature, and use a suitable organic solvent as the medium to carry out nucleophilic substitution reaction. This process is like a boat in water, and the reaction conditions need to be precisely controlled. If the temperature is too high, side reactions will be plentiful, and if it is too low, the reaction will be slow. After careful operation, the target product can be obtained.
    Second, with the help of metal catalysis. Transition metal catalysts, such as palladium, copper and other compounds, are combined with ligands to construct a catalytic system. Pyrrole derivatives are mixed with tert-butyl-1 (5H) -carboxylate derivatives, and the reaction is heated under the protection of inert gas. In this case, the metal catalyst is like a commanding general, guiding the reaction direction, promoting the formation and rearrangement of chemical bonds, and efficiently generating tert-butyl-2H-pyrrole-1 (5H) -carboxylate.
    Third, a multi-step reaction strategy is adopted. First, pyrrole is functionalized, such as introducing suitable protective groups, to locate the subsequent reaction check point. Then through a series of nucleophilic addition, elimination, substitution and other reactions, the structure of the target molecule is gradually constructed, and the protective group is finally removed to obtain pure tert-butyl-2H-pyrrole-1 (5H) -carboxylate. Although this path is complicated, each step can be finely regulated to ensure the purity and yield of the product.
    What are the physical properties of tert - butyl - 2H - pyrrole - 1 (5H) -carboxylate?
    Tert-butyl-2H-pyrrole-1 (5H) -formate is one of the organic compounds. Its physical properties can be studied in detail.
    In terms of its appearance, it is often colorless to light yellow liquid or solid, which varies depending on the ambient temperature and pressure. Its melting point and boiling point are the key characteristics for identifying this substance. The melting point, or due to intermolecular forces, falls in a specific temperature range. At this temperature, the substance gradually melts from the solid state to the liquid state. The boiling point is related to the energy required for the molecule to break free from the liquid phase and turn into the gas phase. If the ambient pressure is standard atmospheric pressure, its boiling point also has a corresponding value, because of the interaction of intermolecular forces and molecular structure. < Br >
    The density of this substance is also an important physical property. Density is used to characterize the mass of the substance per unit volume. The value reflects the close degree of molecular arrangement and is related to molecular size and structure. And its solubility is also worthy of attention. It may have good solubility in organic solvents such as ethanol and ether. Due to the principle of similarity and miscibility, that is, molecules with similar polarities are easy to mix with each other. The solubility in water may be slightly soluble or even insoluble due to the difference between molecular polarity and water molecular polarity.
    The refractive index of tert-butyl-2H-pyrrole-1 (5H) -formate is also one of its characteristics. The refractive index is related to the degree of refraction of light when it passes through the object, and is related to the distribution of the electron cloud and the molecular structure of the molecule, which can provide important clues for the analysis and identification of this substance.
    In addition, the vapor pressure of this substance cannot be ignored. Vapor pressure is the pressure of the vapor phase when a substance reaches equilibrium with its vapor phase at a certain temperature. The magnitude of vapor pressure reflects the volatility of a substance and the difficulty of vaporization of this substance in a specific environment.
    Tert - butyl - 2H - pyrrole - 1 (5H) -carboxylate What are the precautions in storage and transportation?
    Tert-butyl-2H-pyrrole-1 (5H) -carboxylic acid ester is a kind of organic compound. During storage and transportation, many important items need to be paid attention to.
    First storage. This compound should be placed in a cool and dry place, away from fire and heat sources. The cover is easily triggered by chemical reactions or the risk of combustion or explosion due to its certain chemical activity. And it needs to be sealed and stored to prevent it from contacting with moisture, oxygen and other substances in the air. Moisture or hydrolysis, oxygen or oxidation, both of which can damage the purity and quality of the compound.
    Times and transportation. When transporting, make sure that the packaging is intact. Packaging materials should have good sealing and protective properties, which can resist vibration, collision and friction to prevent compound leakage caused by package rupture. At the same time, the transportation environment is also crucial, and it is advisable to maintain appropriate temperature and humidity to avoid extreme conditions. And it should strictly follow relevant transportation regulations and safety standards, and be equipped with necessary emergency treatment equipment and protective equipment to prevent emergencies during transportation.
    Furthermore, whether it is storage or transportation, it is necessary to have a detailed understanding of the nature, hazards and emergency treatment methods of the compound. Operators should be professionally trained and familiar with operating norms and safety precautions. In case of accidents such as leakage, they can be disposed of quickly and properly to minimize harm. In this way, the safety and stability of tert-butyl-2H-pyrrole-1 (5H) -carboxylate during storage and transportation can be ensured.