CAS 352-24-9

Butanoic acid, 4,4-difluoro-3-oxo-, ethyl ester

Description:

Butanoic acid, 4,4-difluoro-3-oxo-, ethyl ester, also known by its CAS number 352-24-9, is an organic compound characterized by its ester functional group derived from butanoic acid. This compound features a butanoic acid backbone with a ketone group at the 3-position and two fluorine atoms at the 4-position, which significantly influence its chemical properties. The presence of fluorine atoms typically enhances the compound's lipophilicity and can affect its reactivity and stability. As an ethyl ester, it is likely to exhibit moderate volatility and solubility in organic solvents, while being less soluble in water due to its hydrophobic characteristics. The compound may be utilized in various applications, including as an intermediate in organic synthesis or in the production of pharmaceuticals and agrochemicals. Its unique structure may also impart specific biological activities, making it of interest in medicinal chemistry. Safety data should be consulted for handling and usage, as fluorinated compounds can exhibit distinct toxicological profiles.

Formula: C₆H₈F₂O₃

InChI: InChI=1S/C6H8F2O3/c1-2-11-5(10)3-4(9)6(7)8/h6H,2-3H2,1H3

InChI key: InChIKey=CBDPWKVOPADMJC-UHFFFAOYSA-N

SMILES: C(CC(C(F)F)=O)(OCC)=O

Synonyms:

• 4,4-Difluoro-3-oxo butyric acid ethyl ester
• 4,4-Difluoro-3-oxobutanoic acid ethyl ester
• 4,4-Difluoroacetoacetic acid ethyl ester
• 4,4-Ethyl Difluoroacetoacetate
• Acetoacetic acid, 4,4-difluoro-, ethyl ester
• Butanoic acid, 4,4-difluoro-3-oxo-, ethyl ester
• Ethyl 4,4-Difluoro-3-Oxobutanoate
• Ethyl 4,4-difluoroacetoacetate

Ethyl 4,4-difluoroacetoacetate

CAS: 352-24-9

Formula: C₆H₈F₂O₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 166.1227

Ref: IN-DA0037M5

Ethyl 4,4-difluoroacetoacetate

CAS: 352-24-9

Ethyl 4,4-difluoroacetoacetate

Formula: C₆H₈F₂O₃

Purity: 97%

Color and Shape: clear. colourless liquid

Molecular weight: 166.12272g/mol

Ref: 54-PC5945

Ethyl 4,4-Difluoroacetoacetate

CAS: 352-24-9

Formula: C₆H₈F₂O₃

Purity: >96.0%(GC)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 166.12

Ref: 3B-E1018

Ethyl 4,4-difluoroacetoacetate

CAS: 352-24-9

Formula: C₆H₈F₂O₃

Purity: 90%

Color and Shape: Liquid, Clear

Molecular weight: 166.124

Ref: 10-F001566

Ethyl 4,4-Difluoroacetoacetate

Controlled Product

CAS: 352-24-9

Applications Ethyl 4,4-Difluoroacetoacetate is an intermediate used for the synthesis of pharmaceuticals such as potassium channel activators and β-alanine derived GABA-T antagonists.
References Qi, J.L., et al.: Euro. J. Medn. Chem., 46, 934 (2011); Schirlin, D., et al.: J. Enzymes. Inhibition., 1, 243 (1987);

Formula: C₆H₈F₂O₃

Color and Shape: Neat

Molecular weight: 166.12

Ref: TR-E678440