1H-Pyrazole-4-carbonitrile, 5-amino-1-methyl-


Chemical Name: 1H-Pyrazole-4-carbonitrile, 5-amino-1-methyl-
CAS Number: 5334-41-8
Product Number: AG003MCN(AGN-PC-0JN9R7)
Synonyms:
MDL No:
Molecular Formula: C5H6N4
Molecular Weight: 122.1279

Identification/Properties


Properties
MP:
221-213 °C
BP:
342.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
122.131g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
122.059g/mol
Monoisotopic Mass:
122.059g/mol
Topological Polar Surface Area:
67.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
146
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


NMR Spectrum


Other Analytical Data


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