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CAS 94135-58-7

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1-[5-Fluoro-2-(2-oxiranylmethoxy)phenyl]-1-butanone

Description:
1-[5-Fluoro-2-(2-oxiranylmethoxy)phenyl]-1-butanone, with the CAS number 94135-58-7, is a synthetic organic compound characterized by its unique molecular structure, which includes a butanone moiety and a fluoro-substituted phenyl group. The presence of the epoxide (oxirane) functional group indicates potential reactivity, particularly in nucleophilic addition reactions. This compound may exhibit properties typical of both ketones and aromatic compounds, such as volatility and the ability to participate in electrophilic aromatic substitution. The fluorine atom can influence the compound's electronic properties, potentially enhancing its lipophilicity and altering its reactivity compared to non-fluorinated analogs. Additionally, the compound's structure suggests potential applications in medicinal chemistry or as an intermediate in organic synthesis, although specific biological activities or applications would require further investigation. Overall, the characteristics of this compound make it a subject of interest in various fields, including pharmaceuticals and materials science.
Formula:C13H15FO3
InChI:InChI=1S/C13H15FO3/c1-2-3-12(15)11-6-9(14)4-5-13(11)17-8-10-7-16-10/h4-6,10H,2-3,7-8H2,1H3
InChI key:InChIKey=ODMPDMZOLGOXHX-UHFFFAOYSA-N
SMILES:C(CCC)(=O)C1=C(OCC2CO2)C=CC(F)=C1
Synonyms:
  • 1-Butanone, 1-[5-fluoro-2-(2-oxiranylmethoxy)phenyl]-
  • 1-Butanone, 1-[5-fluoro-2-(oxiranylmethoxy)phenyl]-
  • 1-[5-Fluoro-2-(2-oxiranylmethoxy)phenyl]-1-butanone
  • 1-[5-Fluoro-2-(Oxiran-2-Ylmethoxy)Phenyl]Butan-1-One
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