Ethanone, 2,2,2-trifluoro-1-(3-methylphenyl)-


Chemical Name: Ethanone, 2,2,2-trifluoro-1-(3-methylphenyl)-
CAS Number: 1736-06-7
Product Number: AG001Z2J(AGN-PC-0KKNPZ)
Synonyms:
MDL No:
Molecular Formula: C9H7F3O
Molecular Weight: 188.1465

Identification/Properties


Properties
BP:
194.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
188.149g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
188.045g/mol
Monoisotopic Mass:
188.045g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
198
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2,2,2-Trifluoro-1-(3-methylphenyl)ethanone, also known as $name$, is a versatile compound widely used in chemical synthesis. This compound plays a crucial role in organic chemistry as a valuable building block for the creation of various pharmaceuticals, agrochemicals, and materials. Its unique structure and properties make it a key ingredient in the development of complex molecules with specific functional groups. In chemical synthesis, $name$ is often employed as a starting material or intermediate in the preparation of advanced organic compounds through processes such as acylation, alkylation, and condensation reactions. This compound enables chemists to introduce fluorine and phenyl substituents into target molecules, enhancing their stability, reactivity, and biological activity. Additionally, the trifluoromethyl group in $name$ imparts desirable properties such as increased lipophilicity and metabolic stability to the synthesized compounds, making it a valuable tool for medicinal and materials chemistry research.