[1,2,4]Triazolo[1,5-a]pyrimidine


Chemical Name: [1,2,4]Triazolo[1,5-a]pyrimidine
CAS Number: 275-02-5
Product Number: AG002TXV(AGN-PC-0JU5V4)
Synonyms:
MDL No:
Molecular Formula: C5H4N4
Molecular Weight: 120.1121

Identification/Properties


Properties
MP:
142-145 °C(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
120.115g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
120.044g/mol
Monoisotopic Mass:
120.044g/mol
Topological Polar Surface Area:
43.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
105
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



[1,2,4]Triazolo[1,5-a]pyrimidine is a versatile heterocyclic compound widely used in chemical synthesis. This unique structure enables its application in the development of novel pharmaceuticals, agrochemicals, and materials. In organic synthesis, [1,2,4]Triazolo[1,5-a]pyrimidine serves as a valuable building block for the construction of complex molecular structures with diverse biological activities. Its presence in drug design contributes to the exploration of new therapeutic agents targeting various diseases. Furthermore, [1,2,4]Triazolo[1,5-a]pyrimidine's utility in material science allows for the fabrication of advanced materials with tailored properties for a wide range of applications. Its incorporation into the design of molecular frameworks showcases its significant role in advancing chemical synthesis strategies.