CAS 835878-82-5

1-(2,4,6-Trifluorophenyl)-2-propanone

Description:

1-(2,4,6-Trifluorophenyl)-2-propanone, with the CAS number 835878-82-5, is an organic compound characterized by its ketone functional group and a trifluorinated phenyl substituent. This compound features a propanone backbone, where the carbonyl group (C=O) is attached to a propyl chain, and a phenyl ring that is substituted with three fluorine atoms at the 2, 4, and 6 positions. The presence of these electronegative fluorine atoms significantly influences the compound's physical and chemical properties, such as increasing its polarity and potentially enhancing its reactivity. This compound may exhibit unique solubility characteristics, often being soluble in organic solvents while having limited solubility in water. Additionally, the trifluorophenyl group can impart interesting electronic properties, making it a candidate for various applications in pharmaceuticals, agrochemicals, and materials science. Safety data should be consulted for handling and storage, as fluorinated compounds can pose specific health and environmental risks.

Formula: C₉H₇F₃O

InChI: InChI=1S/C9H7F3O/c1-5(13)2-7-8(11)3-6(10)4-9(7)12/h3-4H,2H2,1H3

InChI key: InChIKey=NAKZSJUHEAAUHN-UHFFFAOYSA-N

SMILES: C(C(C)=O)C1=C(F)C=C(F)C=C1F

Synonyms:

• 2-Propanone, 1-(2,4,6-trifluorophenyl)-
• 1-(2,4,6-Trifluorophenyl)-2-propanone
• 1-(2,4,6-Trifluorophenyl)propan-2-one