Benzenamine, 3-(5-methyl-1,3,4-oxadiazol-2-yl)-


Chemical Name: Benzenamine, 3-(5-methyl-1,3,4-oxadiazol-2-yl)-
CAS Number: 122733-40-8
Product Number: AG000J7Y(AGN-PC-001C4Y)
Synonyms:
MDL No:
Molecular Formula: C9H9N3O
Molecular Weight: 175.1873

Identification/Properties


Computed Properties
Molecular Weight:
175.191g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
175.075g/mol
Monoisotopic Mass:
175.075g/mol
Topological Polar Surface Area:
64.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
176
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-(5-Methyl-1,3,4-oxadiazol-2-yl)aniline is a versatile compound commonly utilized in chemical synthesis for its unique properties and reactivity. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and other fine chemicals. Due to its specific structural features, 3-(5-Methyl-1,3,4-oxadiazol-2-yl)aniline can participate in a range of chemical reactions, including nucleophilic substitutions, condensations, and heterocyclic transformations. Its presence in the molecule imparts desirable biological activities and physical properties, making it an essential component in the development of novel compounds with potential applications in drug discovery and materials science. In summary, the strategic incorporation of 3-(5-Methyl-1,3,4-oxadiazol-2-yl)aniline in chemical synthesis enhances the diversity and efficiency of compound production, paving the way for innovative advancements in various scientific fields.