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


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-nitro-
CAS Number: 16632-21-6
Product Number: AG001WN7(AGN-PC-0JLVQX)
Synonyms:
MDL No:
Molecular Formula: C5H5N3O4
Molecular Weight: 171.1109

Identification/Properties


Properties
MP:
290-291°C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
171.112g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
171.028g/mol
Monoisotopic Mass:
171.028g/mol
Topological Polar Surface Area:
104A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
300
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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