2(1H)-Quinolinone, 6-fluoro-4-(trifluoromethyl)-


Chemical Name: 2(1H)-Quinolinone, 6-fluoro-4-(trifluoromethyl)-
CAS Number: 328956-08-7
Product Number: AG003N7L(AGN-PC-00FBN7)
Synonyms:
MDL No:
Molecular Formula: C10H5F4NO
Molecular Weight: 231.1464

Identification/Properties


Properties
BP:
281.568°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
231.15g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
231.031g/mol
Monoisotopic Mass:
231.031g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
336
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

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NMR Spectrum


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Chemical Structure



6-Fluoro-4-(trifluoromethyl)quinolin-2(1H)-one is a versatile compound widely utilized in chemical synthesis due to its unique structural properties and reactivity. This compound serves as a valuable building block in the development of various pharmaceuticals, agrochemicals, and fine chemicals. Through its strategic incorporation into synthetic pathways, it enables the introduction of functional groups, such as fluorine atoms, which can impart desirable characteristics like enhanced biological activity or improved physicochemical properties. Furthermore, 6-Fluoro-4-(trifluoromethyl)quinolin-2(1H)-one can act as a key intermediate in the synthesis of complex molecules, facilitating efficient and controlled transformations to access structurally diverse compounds. Its role in promoting regioselective and stereoselective reactions makes it a valuable tool for chemists striving to design and produce novel chemical entities with tailored properties and functionalities.