CAS 1184224-97-2

3-Methyl-1-[3-(trifluoromethyl)phenyl]-1-butanone

Description:

3-Methyl-1-[3-(trifluoromethyl)phenyl]-1-butanone, identified by its CAS number 1184224-97-2, is an organic compound characterized by its ketone functional group. This substance features a branched alkyl chain with a methyl group and a phenyl ring that is substituted with a trifluoromethyl group, which significantly influences its chemical properties. The presence of the trifluoromethyl group enhances the compound's lipophilicity and can affect its reactivity and interaction with biological systems. Typically, compounds of this nature may exhibit interesting properties such as volatility and potential applications in pharmaceuticals or agrochemicals. The molecular structure suggests that it may participate in various chemical reactions, including nucleophilic additions and substitutions, due to the electrophilic nature of the carbonyl carbon. Additionally, the trifluoromethyl group can impart unique electronic characteristics, making it a subject of interest in synthetic organic chemistry. Safety and handling considerations should be taken into account, as with many organic compounds, due to potential toxicity or environmental impact.

Formula: C₁₂H₁₃F₃O

InChI: InChI=1S/C12H13F3O/c1-8(2)6-11(16)9-4-3-5-10(7-9)12(13,14)15/h3-5,7-8H,6H2,1-2H3

InChI key: InChIKey=BNJMKJLTHQZXOJ-UHFFFAOYSA-N

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

Synonyms:

• 3-Methyl-1-[3-(trifluoromethyl)phenyl]-1-butanone
• 1-Butanone, 3-methyl-1-[3-(trifluoromethyl)phenyl]-

3-Methyl-1-[3-(trifluoromethyl)phenyl]butan-1-one

CAS: 1184224-97-2

Versatile small molecule scaffold

Formula: C₁₂H₁₃F₃O

Purity: Min. 95%

Molecular weight: 230.23 g/mol

Ref: 3D-JXB22497