Pyrazinecarbonitrile, 3-amino-6-bromo-


Chemical Name: Pyrazinecarbonitrile, 3-amino-6-bromo-
CAS Number: 17231-51-5
Product Number: AG003IWW(AGN-PC-0NF3FO)
Synonyms:
MDL No: MFCD06658300
Molecular Formula: C5H3BrN4
Molecular Weight: 199.0081

Identification/Properties


Properties
MP:
181 - 183 °C
BP:
305.6°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.011g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
197.954g/mol
Monoisotopic Mass:
197.954g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
162
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:
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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