Cas no 88463-19-8 (Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester)

Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester, is a specialized organic compound with a carbamate functional group, offering utility in synthetic and medicinal chemistry applications. Its structure, featuring both amide and ester moieties, provides versatility as an intermediate in peptide synthesis or as a protecting group for amines. The phenylmethyl ester component enhances solubility in organic solvents, facilitating reactions under mild conditions. The branched methylpropyl group may contribute to steric effects, influencing selectivity in nucleophilic reactions. This compound’s stability and functional group compatibility make it suitable for controlled derivatization in complex molecular frameworks. Proper handling and storage are recommended due to potential sensitivity to hydrolysis.
Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester structure
88463-19-8 structure
Product Name:Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester
CAS No:88463-19-8
MF:C13H18N2O3
MW:250.293623447418
CID:631871
PubChem ID:14481111
Update Time:2025-05-25

Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester Chemical and Physical Properties

Names and Identifiers

    • Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester
    • benzyl N-(1-amino-3-methyl-1-oxobutan-2-yl)carbamate
    • SCHEMBL7331078
    • Benzyl (1-amino-3-methyl-1-oxobutan-2-yl)carbamate
    • DTXSID90560825
    • N-Cbz-L-valinamide
    • EN300-7079602
    • MFCD00191170
    • SY042612
    • 88463-19-8
    • benzyl N-(1-carbamoyl-2-methylpropyl)carbamate
    • Inchi: 1S/C13H18N2O3/c1-9(2)11(12(14)16)15-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H2,14,16)(H,15,17)
    • InChI Key: LWAHIZLDUQONHV-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C(NC(C(N)=O)C(C)C)=O

Computed Properties

  • Exact Mass: 250.13174244g/mol
  • Monoisotopic Mass: 250.13174244g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 6
  • Complexity: 286
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.7
  • Topological Polar Surface Area: 81.4?2

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Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester Related Literature

Additional information on Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester

Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester (CAS No. 88463-19-8): A Comprehensive Overview

Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester, identified by its CAS number 88463-19-8, is a specialized organic compound that has garnered significant attention in the field of pharmaceutical and chemical research. This compound, with its unique structural properties, exhibits potential applications in various biochemical pathways and drug development processes. The detailed exploration of its chemical characteristics, synthesis methods, and emerging research applications provides a comprehensive understanding of its significance in modern science.

The molecular structure of Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester consists of a carbamic acid moiety linked to a phenylmethyl ester group, with an additional 1-(aminocarbonyl)-2-methylpropyl side chain. This intricate arrangement contributes to its reactivity and makes it a valuable intermediate in organic synthesis. The presence of multiple functional groups allows for diverse chemical modifications, which are crucial for tailoring the compound's properties for specific applications.

In recent years, the compound has been studied for its potential role in the development of novel pharmaceutical agents. Its structural features suggest that it may interact with biological targets in ways that could lead to innovative therapeutic strategies. For instance, the carbamic acid group can participate in hydrogen bonding interactions, which are essential for enzyme inhibition and receptor binding. This property makes it particularly interesting for designing drugs that target enzymes involved in metabolic pathways or signal transduction processes.

One of the most promising areas of research involving Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester is its application as a building block in the synthesis of more complex molecules. Researchers have utilized this compound to create derivatives with enhanced pharmacological properties. For example, modifications to the side chain or the ester group can alter the compound's solubility, bioavailability, and metabolic stability. These adjustments are critical for optimizing drug candidates for clinical use.

The synthesis of Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester involves multi-step organic reactions that require precise control over reaction conditions. Common synthetic routes include condensation reactions between appropriate precursors followed by purification steps to isolate the desired product. Advances in synthetic methodologies have enabled more efficient and scalable production processes, making it feasible to study this compound in larger quantities for both laboratory research and potential industrial applications.

The compound's potential applications extend beyond pharmaceuticals into other areas such as agrochemicals and material science. Its structural versatility allows for the creation of novel polymers or specialty chemicals with tailored properties. For instance, derivatives of this compound have been explored as monomers in polymer synthesis, where they contribute to the development of materials with improved mechanical strength or thermal stability.

In conclusion, Carbamic acid, [1-(aminocarbonyl)-2-methylpropyl]-, phenylmethyl ester (CAS No. 88463-19-8) is a multifaceted compound with significant potential in various scientific domains. Its unique molecular structure and functional groups make it a valuable tool for researchers working on drug development, organic synthesis, and material science. As ongoing studies continue to uncover new applications and refine synthetic techniques, this compound is poised to play an increasingly important role in advancing scientific knowledge and technological innovation.

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