2,4(1H,3H)-Pyrimidinedione, 6-amino-5-nitro-


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 6-amino-5-nitro-
CAS Number: 3346-22-3
Product Number: AG003N2O(AGN-PC-0JNYIO)
Synonyms:
MDL No:
Molecular Formula: C4H4N4O4
Molecular Weight: 172.0990

Identification/Properties


Properties
MP:
>300°C
BP:
561.7°C at 760 mmHg
Storage:
Room Temperature;Inert atmosphere;Light sensitive;
Form:
Solid
Computed Properties
Molecular Weight:
172.1g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
172.023g/mol
Monoisotopic Mass:
172.023g/mol
Topological Polar Surface Area:
130A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
301
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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