Ethanone, 1-[4-fluoro-2-(trifluoromethyl)phenyl]-


Chemical Name: Ethanone, 1-[4-fluoro-2-(trifluoromethyl)phenyl]-
CAS Number: 208173-21-1
Product Number: AG002JJQ(AGN-PC-0KK8L2)
Synonyms:
MDL No: MFCD00061251
Molecular Formula: C9H6F4O
Molecular Weight: 206.1370

Identification/Properties


Properties
BP:
212°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.4475
Computed Properties
Molecular Weight:
206.14g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
206.035g/mol
Monoisotopic Mass:
206.035g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
223
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound 1-(4-Fluoro-2-(trifluoromethyl)phenyl)ethanone, also known as $name$, serves as a versatile building block in chemical synthesis due to its unique chemical properties. This molecule is commonly employed as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals. Its trifluoromethyl group enhances the compound's lipophilicity and metabolic stability, making it a valuable candidate in drug design and development. Furthermore, the fluoro substituent offers opportunities for selective functionalization, enabling the creation of diverse molecular structures with tailored properties. In organic synthesis, $name$ can participate in a range of transformations including nucleophilic addition, condensation reactions, and metal-catalyzed coupling reactions, thereby facilitating the construction of complex organic frameworks. The strategic incorporation of 1-(4-Fluoro-2-(trifluoromethyl)phenyl)ethanone into synthetic pathways enables the rapid assembly of target molecules with high efficiency and precision, making it a valuable tool for chemists in the pursuit of novel compounds with potential therapeutic, agricultural, or materials applications.