2-bromo-4-fluoro-5-methylbenzonitrile


Chemical Name: 2-bromo-4-fluoro-5-methylbenzonitrile
CAS Number: 916792-07-9
Product Number: AG003GO3(AGN-PC-058CG6)
Synonyms:
MDL No: MFCD07782070
Molecular Formula: C8H5BrFN
Molecular Weight: 214.0344

Identification/Properties


Properties
BP:
291℃
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
214.037g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
212.959g/mol
Monoisotopic Mass:
212.959g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
186
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


Other Analytical Data


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Chemical Structure



2-Bromo-4-fluoro-5-methylbenzonitrile is a key intermediate in the field of chemical synthesis, valued for its versatile applications. This compound serves as a building block in the preparation of various pharmaceuticals, agrochemicals, and materials. By utilizing 2-Bromo-4-fluoro-5-methylbenzonitrile in the synthesis process, chemists can introduce specific functional groups and structural motifs into target molecules, enhancing their biological activity or physical properties. Its reactivity allows for the formation of complex molecular architectures, making it a valuable tool in the development of new compounds with tailored properties. Additionally, 2-Bromo-4-fluoro-5-methylbenzonitrile's compatibility with a wide range of reaction conditions makes it a versatile and reliable reagent for organic synthesis strategies.