S Methyl 2 Tert Butoxycarbonylamino 3 Iodopropanoate
Iodobenzene

(s)-methyl 2-(tert-butoxycarbonylamino)-3-iodopropanoate

Fengxi Chemical

Specifications

HS Code

377571

Chemical Formula C10H18INO4
Molar Mass 343.16 g/mol
Appearance Typically a solid
Solubility Soluble in some organic solvents
Melting Point Varies, specific value needs experimental determination
Density Value depends on physical state and conditions
Reactivity Reactive towards nucleophiles due to the iodide group
Stability Stable under normal conditions but may decompose on heating
Chirality Has a chiral center at the carbon attached to the amino and iodide groups
Chemical Formula C10H18INO4
Molar Mass 343.16 g/mol
Appearance Solid (usually white or off - white)
Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform
Solubility In Water Poorly soluble in water
Boiling Point Decomposes before boiling (due to heat - sensitive functional groups)
Melting Point Specific value would require experimental determination, but expected to be in a range typical for organic solids
Purity Can be obtained in high purity (e.g., 95%+ in laboratory - grade preparations)
Stability Sensitive to light and moisture, should be stored in a cool, dry, and dark place
Functional Groups tert - butoxycarbonylamino group, iodide, ester group
Chemical Formula C10H18INO4
Molar Mass 343.16 g/mol
Appearance Solid (usually white or off - white)
Physical State At Room Temperature Solid
Solubility In Common Solvents Soluble in organic solvents like dichloromethane, less soluble in water
Melting Point Typically in a certain range (reported values may vary depending on purity)
Density Estimated based on similar compounds, density around 1.6 - 1.8 g/cm³
Stability Sensitive to heat, light, and moisture; the tert - butoxycarbonyl group can be cleaved under acidic conditions, and the iodine can be involved in substitution reactions
Chemical Formula C10H18INO4
Molar Mass 343.158 g/mol
Appearance Typically a solid (appearance can vary based on purity and preparation)
Solubility Solubility characteristics depend on the solvent; may be soluble in some organic solvents like dichloromethane
Melting Point Specific melting point data would need to be experimentally determined
Density Density information requires experimental measurement
Purity Purity can vary depending on the source and manufacturing process
Reactivity Reactive due to the presence of the iodine atom and the Boc - protected amino group; can participate in substitution and coupling reactions
Stability Stability may be affected by factors such as light, heat, and moisture; the Boc group can be removed under acidic conditions
Packing & Storage
Packing 500g of (s)-methyl 2-(tert -butoxycarbonylamino)-3-iodopropanoate in sealed, labeled containers.
Storage (s)-Methyl 2-(tert -butoxycarbonylamino)-3-iodopropanoate should be stored in a cool, dry place away from direct sunlight. Keep it in a tightly sealed container to prevent moisture and air exposure, which could potentially degrade the chemical. Store it separately from incompatible substances, like strong oxidizers or reducing agents, in a well - ventilated chemical storage area.
Shipping (S)-methyl 2-(tert -butoxycarbonylamino)-3-iodopropanoate is shipped in well - sealed containers. Precautions are taken to prevent breakage and exposure. Shipment adheres to chemical transportation regulations to ensure safety during transit.
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(s)-methyl 2-(tert-butoxycarbonylamino)-3-iodopropanoate (s)-methyl 2-(tert-butoxycarbonylamino)-3-iodopropanoate (s)-methyl 2-(tert-butoxycarbonylamino)-3-iodopropanoate
General Information
Frequently Asked Questions
What is the chemical structure of (s) -methyl 2- (tert-butoxycarbonylamino) -3-iodopropanoate
The chemical structure of (s) -methyl 2 - (tert-butoxycarbonylamino) -3 -iodopropionate is an important content in the field of organic chemistry. Its structure can be viewed as follows:
The main chain of this compound is a propionate structure, and the carboxyl group of propionic acid and the hydroxyl group of methanol are esterified to form an ester group, that is, the -COOCH 🥰 part, which is one of the key structural fragments of the molecule. At the α-carbon position of propionic acid, there is a specific chiral center of the (s) configuration, which endows the molecule with specific stereochemical characteristics.
Furthermore, there is also an amino group attached to α-carbon, but above this amino group, it is protected by tert-butoxycarbonyl (Boc), that is, the -NH (COOC (CH <
)) structure. The introduction of tert-butoxycarbonyl can avoid unnecessary reactions of the amino group in the process of organic synthesis. When the time is right, it can be selectively removed to exert the reactivity of the amino group.
The β-carbon position of propionic acid is connected with an iodine atom, a fragment of -CH < 2 I structure, and an iodine atom. Due to its good departure properties, this compound exhibits unique reactivity in many organic reactions, such as nucleophilic substitution reactions.
In summary, the chemical structure of (s) -methyl 2- (tert-butoxycarbonyl amino) -3 -iodopropionate is composed of ester groups, chiral α-carbons and structural fragments such as protective amino groups attached to them, and iodine atoms on β-carbons. Each part affects each other to determine its chemical properties and reactivity.
What are the main uses of (s) -methyl 2- (tert-butoxycarbonylamino) -3-iodopropanoate?
(S) -methyl 2 - (tert-butoxycarbonyl amino) -3 -iodopropionate is an important chemical substance in organic synthesis. Its main uses cover the following numbers.
First, in the field of peptide synthesis, it is often used as a key intermediate. Peptide synthesis is related to many fields, such as drug development, biochemical research, etc. The tert-butoxycarbonyl amino group of this compound can effectively protect the amino group and prevent it from participating in unexpected reactions for no reason during the reaction process, ensuring the precise and orderly synthesis process. When appropriate, the tert-butoxycarbonyl can be gently removed to restore the activity of the amino group and participate in the subsequent reaction, which is very powerful in constructing the specific sequence of polypeptides.
Second, in terms of medicinal chemistry, it can be used to create new drugs. The presence of 3-iodine atoms gives the molecule unique reactivity. Iodine atoms can be connected to other organic fragments through a variety of chemical reactions, such as coupling reactions, thereby expanding the structural diversity of molecules, helping to discover novel compounds with biological activities, and opening up paths for the development of specific drugs.
Third, in the study of organic synthesis methodologies, (S) -methyl 2- (tert-butoxycarbonyl amino) -3 -iodopropionate is also a common tool. Chemists can explore new reaction mechanisms and synthesis strategies by studying various reactions in which it participates, and promote the development of organic synthetic chemistry.
Fourth, in the field of modification of bioactive molecules, it can be used to modify existing bioactive molecules. By introducing this structural fragment, the physical and chemical properties of the molecule, such as lipophilicity, polarity, etc., can be changed to optimize the pharmacokinetic properties of bioactive molecules and improve their efficacy and bioavailability.
In conclusion, (S) -methyl 2- (tert-butoxycarbonylamino) -3 -iodopropionate plays an indispensable role in many fields such as organic synthesis and drug development, and has made outstanding contributions to the advancement of related scientific fields.
What are the synthesis methods of (s) -methyl 2- (tert-butoxycarbonylamino) -3-iodopropanoate
The synthesis of (s) -methyl-2- (tert-butoxycarbonyl amino) -3-iodopropionate is of great interest in the field of organic synthesis. The synthesis method often involves several steps of reaction.
First, the amino group is protected by tert-butoxycarbonyl (Boc) with a suitable amino acid as the starting material. This is a commonly used protective group strategy to avoid amino interference in subsequent reactions. Usually, the reaction of tert-butoxycarbonyl anhydride (Boc 2O O) with amino acids in an alkaline environment, such as sodium carbonate or triethylamine, can make the amino group protected by Boc, and the corresponding Boc-amino acid derivative can be obtained. In the second case, the carboxyl group is esterified. The esterification reaction between methanol and the above Boc-amino acid derivatives under acid catalysis, such as p-toluenesulfonic acid, is heated and refluxed to obtain (s) -methyl-2- (tert-butoxycarbonylamino) propionate. In the last case, the iodine atom is introduced into the α-carbon of the propionate. The commonly used method is to treat the above ester with a strong base, such as lithium diisopropylamide (LDA), to form an enolate intermediate, and then react with an iodine reagent, such as iodomethane or elemental iodine, to obtain the target product (s) -methyl-2 - (tert-butoxycarbonylamino) -3 -iodopropionate.
When synthesizing, it is necessary to pay attention to the conditions of each step of the reaction, such as temperature, pH, reaction time, etc. After each step of the reaction, it is often necessary to separate and purify, such as column chromatography, recrystallization, etc., to ensure the purity of the product, and then to obtain high-quality (s) -methyl-2 - (tert-butoxycarbonyl amino) -3 -iodopropionate.
What are the physical properties of (s) -methyl 2- (tert-butoxycarbonylamino) -3-iodopropanoate
(S) -methyl 2 - (tert-butoxycarbonylamino) -3 -iodopropionate is an important compound in organic chemistry. Its physical properties are particularly critical and have a significant impact on many chemical processes.
When it comes to the properties of this compound, it is mostly a colorless to light yellow oily liquid under normal conditions, and the texture is uniform and fluidity. This state is conducive to its participation in various reactions in the solution system. Its morphology makes it suitable for intermolecular interactions and the reactivity can be moderately displayed.
Melting point and boiling point are also important physical properties. However, the exact value varies depending on the purity of the sample and the test conditions. Generally speaking, the melting point is in a relatively low range, indicating that the intermolecular force is not extremely strong. This property makes it easy to change the physical state under moderate heating, which is easy to control during synthesis or processing. The boiling point is relatively high, reflecting that it needs to supply more energy to change from liquid to gaseous state, which is quite meaningful in separation, purification and other operations.
Furthermore, its solubility is also worthy of attention. This compound exhibits good solubility in common organic solvents such as dichloromethane, chloroform, ethyl acetate, etc. This property provides convenience for organic synthesis reactions, because a suitable solvent can be selected to build a reaction system according to the reaction requirements, ensuring that the reactants are fully contacted and promoting the smooth progress of the reaction. However, the solubility in water is poor, which is related to the large proportion of hydrophobic groups in the molecular structure. This property needs to be specially considered in operations or reactions involving the aqueous phase.
In terms of density, it is larger than that of water. If it is in a stratified system, it will be in the lower layer. This property can be used when separating mixed systems containing the compound to assist the separation process by means of density differences.
In addition, the compound has a certain refractive index. This physical constant can be used for analytical work such as purity identification. Because the pure substance has a specific refractive index value, its purity status can be inferred by measurement.
What is the market outlook for (s) -methyl 2- (tert-butoxycarbonylamino) -3-iodopropanoate?
(S) -methyl 2 - (tert-butoxycarbonyl amino) - 3 -iodopropionate, which is a key compound in the field of organic synthesis, is used in many drug development and fine chemical preparation processes.
Looking at its market prospects, since the past, organic synthesis technology has continued to improve, and the demand for high-purity, specific configuration compounds has also continued to rise. (S) -methyl 2 - (tert-butoxycarbonyl amino) - 3 -iodopropionate can be used as an important intermediate in chiral drug synthesis due to its special chiral structure.
In the field of drug research and development, with the deepening of awareness of chiral drugs, many pharmaceutical companies are committed to the creation of chiral drugs. (S) -methyl 2- (tert-butoxycarbonyl amino) -3 -iodopropionate can be converted into chiral drugs with specific pharmacological activities through a series of chemical reactions. Therefore, with the expansion of the chiral drug market, its demand as a key raw material may also rise steadily.
In the preparation of fine chemicals, such as the synthesis of some high-end fragrances, pesticides, etc., or the use of this compound. With people's pursuit of improving quality of life, the high-end fragrance market is gradually expanding; at the same time, the demand for high-efficiency and low-toxicity pesticides is also growing. All of these are addressable market opportunities for (S) -methyl 2- (tert-butoxycarbonyl amino) -3 -iodopropionate.
However, its market development also faces challenges. The process of synthesizing this compound may have high complexity and high cost. To expand market share, researchers and enterprises need to focus on optimizing the synthesis process and reducing production costs. In this way, (S) -methyl 2- (tert-butoxycarbonyl amino) -3 -iodopropionate can occupy a favorable position in the market competition and usher in a broader development prospect.