Cas no 140947-93-9 (Butanoic acid, 2-fluoro-2-methyl-)

Butanoic acid, 2-fluoro-2-methyl-, is a fluorinated carboxylic acid derivative characterized by the presence of a fluorine atom and a methyl group at the alpha position. This structural modification enhances its reactivity and stability, making it a valuable intermediate in organic synthesis, particularly in the preparation of fluorinated pharmaceuticals and agrochemicals. The fluorine substituent influences the compound's electronic and steric properties, enabling selective transformations such as nucleophilic substitutions or esterifications. Its high purity and consistent performance make it suitable for precision applications in medicinal chemistry and material science. The compound is typically handled under controlled conditions due to its potential reactivity.
Butanoic acid, 2-fluoro-2-methyl- structure
140947-93-9 structure
Product Name:Butanoic acid, 2-fluoro-2-methyl-
CAS No:140947-93-9
MF:C5H9FO2
MW:120.122165441513
CID:1308759
PubChem ID:11366977
Update Time:2025-05-20

Butanoic acid, 2-fluoro-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid, 2-fluoro-2-methyl-
    • 2-fluoro-2-methylbutanoic acid
    • 140947-93-9
    • AKOS006382335
    • EN300-7131122
    • 2-fluoro-2-methylbutanoicacid
    • SCHEMBL2682007
    • Inchi: 1S/C5H9FO2/c1-3-5(2,6)4(7)8/h3H2,1-2H3,(H,7,8)
    • InChI Key: WNQJNSIPFOYZPG-UHFFFAOYSA-N
    • SMILES: FC(C(=O)O)(C)CC

Computed Properties

  • Exact Mass: 120.05867
  • Monoisotopic Mass: 120.05865769g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 103
  • 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: 1.3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

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Additional information on Butanoic acid, 2-fluoro-2-methyl-

Butanoic Acid, 2-Fluoro-2-Methyl-

The compound with CAS No. 140947-93-9, commonly referred to as Butanoic acid, 2-fluoro-2-methyl-, is a fluorinated carboxylic acid with significant applications in various fields of chemistry and materials science. This compound is characterized by its unique structure, which includes a four-carbon chain with a fluorine atom and a methyl group attached to the second carbon. The presence of the fluorine atom imparts distinct electronic and steric properties to the molecule, making it a valuable component in the synthesis of advanced materials and pharmaceuticals.

Recent studies have highlighted the importance of Butanoic acid, 2-fluoro-2-methyl- in the development of high-performance polymers. Researchers have utilized this compound as a monomer to create fluoropolymers with enhanced thermal stability and chemical resistance. These polymers are now being explored for use in aerospace applications due to their ability to withstand extreme temperatures and environmental conditions. The fluorine atom's electronegativity plays a crucial role in stabilizing the polymer chains, thereby improving their overall performance.

In addition to its role in polymer synthesis, Butanoic acid, 2-fluoro-2-methyl- has also found applications in drug discovery. Its structure allows for the creation of bioactive molecules with specific pharmacokinetic properties. For instance, this compound has been used as an intermediate in the synthesis of antiviral agents that target RNA-dependent RNA polymerases. The methyl group on the second carbon provides steric hindrance, which can be exploited to design drugs with improved selectivity and reduced toxicity.

The synthesis of Butanoic acid, 2-fluoro-2-methyl- involves a multi-step process that typically begins with the fluorination of a suitable precursor. Recent advancements in catalytic methods have enabled more efficient and environmentally friendly syntheses. For example, the use of transition metal catalysts has significantly reduced reaction times and minimized byproduct formation. These improvements have made the compound more accessible for large-scale production.

From an environmental perspective, Butanoic acid, 2-fluoro-2-methyl- has been studied for its potential role in biodegradable materials. Its fluorinated nature does not hinder biodegradation but rather enhances certain properties such as water resistance without compromising eco-friendliness. This dual functionality makes it an attractive candidate for sustainable packaging solutions.

In conclusion, Butanoic acid, 2-fluoro-2-methyl- (CAS No. 140947-93-9) is a versatile compound with wide-ranging applications across multiple disciplines. Its unique structure and functional groups make it an essential building block in modern chemistry. As research continues to uncover new possibilities for this compound, its role in advancing technology and medicine is expected to grow significantly.

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