CAS 1951442-08-2

1-[4-Nitro-2-(trifluoromethyl)phenyl]-2-octanone

Description:

1-[4-Nitro-2-(trifluoromethyl)phenyl]-2-octanone is an organic compound characterized by its complex structure, which includes a nitro group and a trifluoromethyl group attached to a phenyl ring, along with a ketone functional group. This compound typically exhibits properties associated with both aromatic and aliphatic systems, contributing to its potential reactivity and solubility characteristics. The presence of the nitro group often imparts electron-withdrawing properties, influencing the compound's reactivity in electrophilic aromatic substitution reactions. The trifluoromethyl group enhances lipophilicity and can affect the compound's biological activity. As a ketone, it may participate in various chemical reactions, including nucleophilic additions. The compound's molecular structure suggests potential applications in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis. However, specific safety and handling guidelines should be followed due to the presence of potentially hazardous functional groups. Overall, this compound's unique combination of functional groups makes it a subject of interest in both research and industrial applications.

Formula: C₁₅H₁₈F₃NO₃

InChI: InChI=1S/C15H18F3NO3/c1-2-3-4-5-6-13(20)9-11-7-8-12(19(21)22)10-14(11)15(16,17)18/h7-8,10H,2-6,9H2,1H3

InChI key: InChIKey=CSUWFBRIKWVZTM-UHFFFAOYSA-N

SMILES: C(C(CCCCCC)=O)C1=C(C(F)(F)F)C=C(N(=O)=O)C=C1

Synonyms:

• 1-[4-Nitro-2-(trifluoromethyl)phenyl]-2-octanone
• 2-Octanone, 1-[4-nitro-2-(trifluoromethyl)phenyl]-

1-(2-(TRIFLUOROMETHYL)-4-NITROPHENYL)OCTAN-2-ONE

CAS: 1951442-08-2

Formula: C₁₅H₁₈F₃NO₃

Purity: 95.0%

Molecular weight: 317.308

Ref: 10-F474807