Cas no 824424-73-9 (Butanoic acid, 3-amino-2-ethyl-)

Butanoic acid, 3-amino-2-ethyl-, is a branched-chain amino acid derivative with a carboxylic acid functional group. This compound is of interest in organic synthesis and pharmaceutical applications due to its structural features, which include both an amino and a carboxyl group, enabling versatile reactivity. The ethyl substitution at the 2-position enhances steric influence, potentially affecting selectivity in chemical reactions. Its bifunctional nature allows for use as a building block in peptide mimetics or as an intermediate in the synthesis of more complex molecules. The compound may also serve as a precursor for chiral auxiliaries or ligands in asymmetric catalysis, depending on its enantiomeric purity.
Butanoic acid, 3-amino-2-ethyl- structure
824424-73-9 structure
Product Name:Butanoic acid, 3-amino-2-ethyl-
CAS No:824424-73-9
MF:C6H13NO2
MW:131.172921895981
CID:691087
PubChem ID:541735
Update Time:2025-10-12

Butanoic acid, 3-amino-2-ethyl- Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid, 3-amino-2-ethyl-
    • 3-amino-2-ethylbutanoic acid
    • F75320
    • a-Aminodiaethylessigsaure
    • 3-Amino-2-ethylbutanoic acid #
    • 824424-73-9
    • DTXSID60337309
    • KGMSPEUDMJLUJD-UHFFFAOYSA-N
    • SCHEMBL787988
    • MFCD24498290
    • 3-Amino-2-ethyl-butyric acid
    • Inchi: 1S/C6H13NO2/c1-3-5(4(2)7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
    • InChI Key: KGMSPEUDMJLUJD-UHFFFAOYSA-N
    • SMILES: OC(C(CC)C(C)N)=O

Computed Properties

  • Exact Mass: 131.094628657g/mol
  • Monoisotopic Mass: 131.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 3
  • Complexity: 103
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2.1
  • Topological Polar Surface Area: 63.3?2

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Additional information on Butanoic acid, 3-amino-2-ethyl-

Butanoic Acid, 3-Amino-2-Ethyl: A Comprehensive Overview

Butanoic acid, 3-amino-2-ethyl (CAS No. 824424-73-9) is a chemical compound that has garnered significant attention in the fields of organic chemistry and pharmacology. This compound is a derivative of butanoic acid, with a unique substitution pattern that includes an amino group at the third carbon and an ethyl group at the second carbon. Its structure makes it a versatile molecule with potential applications in drug design, material science, and biochemistry.

Recent studies have highlighted the biological activity of butanoic acid, 3-amino-2-ethyl. Researchers have explored its role as a precursor in the synthesis of bioactive compounds, particularly in the development of peptide-based drugs. The presence of the amino group allows for the formation of amide bonds, which are crucial in peptide synthesis. This property has led to its use in the creation of novel therapeutic agents targeting various diseases, including cancer and neurodegenerative disorders.

The synthesis of butanoic acid, 3-amino-2-ethyl has been optimized through advancements in organic chemistry. Traditional methods involved multi-step reactions with low yields, but recent breakthroughs have introduced more efficient routes using catalytic processes and microwave-assisted synthesis. These improvements have not only enhanced the scalability of production but also reduced environmental impact, aligning with green chemistry principles.

In terms of physical properties, butanoic acid, 3-amino-2-ethyl exhibits a melting point of approximately 15°C and a boiling point around 180°C under standard conditions. Its solubility in water is moderate, making it suitable for applications in both aqueous and organic solvents. The compound's stability under various conditions has been thoroughly investigated, with results indicating that it remains stable under normal storage conditions but may degrade under extreme pH levels or prolonged exposure to heat.

The application potential of butanoic acid, 3-amino-2-ethyl extends beyond pharmaceuticals. It has been explored as a building block in polymer chemistry, where its functional groups can be utilized to create advanced materials with tailored properties. For instance, its incorporation into polyurethanes has shown promise in enhancing mechanical strength and thermal stability.

From an environmental standpoint, the ecotoxicological profile of butanoic acid, 3-amino-2-ethyl has been studied to assess its impact on aquatic ecosystems. Research indicates that it exhibits low toxicity to aquatic organisms at concentrations typically encountered in industrial discharges. However, further studies are recommended to fully understand its long-term effects and degradation pathways in natural environments.

In conclusion, butanoic acid, 3-amino-2-ethyl (CAS No. 824424-73-9) is a compound with diverse applications and promising potential across multiple disciplines. Its unique chemical structure and functional groups make it an invaluable tool in modern chemistry and pharmacology. As research continues to uncover new insights into its properties and applications, this compound is poised to play an increasingly important role in advancing scientific innovation.

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