4(1H)-Pyrimidinone, 5,6-diamino-2,3-dihydro-2-thioxo-


Chemical Name: 4(1H)-Pyrimidinone, 5,6-diamino-2,3-dihydro-2-thioxo-
CAS Number: 1004-76-8
Product Number: AG0001WN(AGN-PC-00H0W4)
Synonyms:
MDL No:
Molecular Formula: C4H6N4OS
Molecular Weight: 158.1816

Identification/Properties


Properties
MP:
>300 °C
BP:
473 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
158.179g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
158.026g/mol
Monoisotopic Mass:
158.026g/mol
Topological Polar Surface Area:
125A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
233
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#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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