2-Pyrimidinamine, 5-nitro-


Chemical Name: 2-Pyrimidinamine, 5-nitro-
CAS Number: 3073-77-6
Product Number: AG00312F(AGN-PC-0JLQ2F)
Synonyms:
MDL No:
Molecular Formula: C4H4N4O2
Molecular Weight: 140.1002

Identification/Properties


Properties
MP:
235-237 °C(lit.)
BP:
402.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.8010 (estimate)
Computed Properties
Molecular Weight:
140.102g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
140.033g/mol
Monoisotopic Mass:
140.033g/mol
Topological Polar Surface Area:
97.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
126
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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