4(1H)-Pyrimidinone, 5,6-diamino-


Chemical Name: 4(1H)-Pyrimidinone, 5,6-diamino-
CAS Number: 1672-50-0
Product Number: AG001X7L(AGN-PC-00H0P1)
Synonyms:
MDL No:
Molecular Formula: C4H6N4O
Molecular Weight: 126.1166

Identification/Properties


Computed Properties
Molecular Weight:
126.119g/mol
XLogP3:
-1.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
126.054g/mol
Monoisotopic Mass:
126.054g/mol
Topological Polar Surface Area:
93.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
205
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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