4(3H)-Pyrimidinone, 6-amino-3-methyl-2-(methylthio)-


Chemical Name: 4(3H)-Pyrimidinone, 6-amino-3-methyl-2-(methylthio)-
CAS Number: 54030-56-7
Product Number: AG00DD78(AGN-PC-0JOISC)
Synonyms:
MDL No:
Molecular Formula: C6H9N3OS
Molecular Weight: 171.2202

Identification/Properties


Properties
MP:
255-258 °C
BP:
282.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
171.218g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
171.047g/mol
Monoisotopic Mass:
171.047g/mol
Topological Polar Surface Area:
84A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
246
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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