CAS 960149-22-8

2-[(6,6-Difluoro-4-cyclooctyn-1-yl)oxy]acetic acid

Description:

2-[(6,6-Difluoro-4-cyclooctyn-1-yl)oxy]acetic acid is a chemical compound characterized by its unique structure, which includes a cyclooctyne moiety and a difluorinated substituent. This compound features an acetic acid functional group, which contributes to its acidic properties. The presence of the difluoro group enhances its reactivity and may influence its solubility and stability in various solvents. The cyclooctyne structure is notable for its strained ring system, which can facilitate certain types of chemical reactions, particularly in click chemistry applications. The compound's molecular interactions are likely influenced by both the electronegative fluorine atoms and the steric effects of the cyclooctyne ring. Overall, this compound may have potential applications in medicinal chemistry, materials science, and bioconjugation due to its distinctive structural features and reactivity profile. As with any chemical substance, safety and handling precautions should be observed, and its properties should be further explored through experimental studies for specific applications.

Formula: C₁₀H₁₂F₂O₃

InChI: InChI=1S/C10H12F2O3/c11-10(12)5-2-1-3-8(4-6-10)15-7-9(13)14/h8H,1,3-4,6-7H2,(H,13,14)

InChI key: InChIKey=ZVEWRLXDIYOFTH-UHFFFAOYSA-N

SMILES: O(CC(O)=O)C1CCC(F)(F)C#CCC1

Synonyms:

• Acetic acid, 2-[(6,6-difluoro-4-cyclooctyn-1-yl)oxy]-
• 2-[(6,6-Difluoro-4-cyclooctyn-1-yl)oxy]acetic acid
• DIFO