1H-1,3-Benzodiazol-5-yl(phenyl)methanamine


Chemical Name: 1H-1,3-Benzodiazol-5-yl(phenyl)methanamine
CAS Number: 929974-45-8
Product Number: AG00H0YK(AGN-PC-0WA4LB)
Synonyms:
MDL No:
Molecular Formula: C14H13N3
Molecular Weight: 223.2731

Identification/Properties


Computed Properties
Molecular Weight:
223.279g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
223.111g/mol
Monoisotopic Mass:
223.111g/mol
Topological Polar Surface Area:
54.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
250
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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



(1H-Benzo[d]imidazol-5-yl);(phenyl);methanamine, commonly known as $name$, is a versatile compound widely used in organic chemical synthesis. With its unique structure consisting of a benzoimidazole ring fused with a phenyl group and a methanamine moiety, $name$ serves as a valuable building block in the creation of various complex molecules.In chemical synthesis, $name$ can be utilized as a key intermediate for the production of pharmaceutical compounds, agrochemicals, and materials for advanced materials. Its structural features provide opportunities for the introduction of functional groups and the modification of molecular properties, making it a valuable tool for synthetic chemists.Moreover, the presence of the benzoimidazole ring in $name$ offers potential biological activities, enhancing its significance in medicinal chemistry research. By incorporating this moiety into drug candidates, researchers can explore novel therapeutic agents with potential antiviral, antibacterial, antifungal, or anticancer properties.Overall, the application of (1H-Benzo[d]imidazol-5-yl);(phenyl);methanamine in chemical synthesis extends beyond basic organic reactions, offering possibilities for the construction of diverse molecules with varied functionalities and potential applications in pharmaceutical and materials science.