1H-Imidazole, 1-(4-bromophenyl)-


Chemical Name: 1H-Imidazole, 1-(4-bromophenyl)-
CAS Number: 10040-96-7
Product Number: AG0001XO(AGN-PC-0KK77T)
Synonyms:
MDL No:
Molecular Formula: C9H7BrN2
Molecular Weight: 223.0693

Identification/Properties


Computed Properties
Molecular Weight:
223.073g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
221.979g/mol
Monoisotopic Mass:
221.979g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
144
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:
H302-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



1-(4-Bromophenyl)imidazole is a versatile compound frequently utilized in chemical synthesis due to its unique properties. This compound serves as a valuable building block in organic chemistry, particularly in the synthesis of pharmaceuticals, agrochemicals, and materials. With its functional group reactivity, it can participate in a variety of chemical reactions, such as nucleophilic substitution, palladium-catalyzed cross-coupling, and electrophilic aromatic substitution. Incorporating 1-(4-Bromophenyl)imidazole into a synthesis pathway allows for the efficient and selective formation of complex molecular structures. Its ability to introduce the bromophenyl moiety into target molecules imparts desired pharmacological or chemical properties. In summary, the application of 1-(4-Bromophenyl)imidazole in chemical synthesis enables the rapid construction of diverse compounds with tailored functionalities for various industrial applications.