5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one


Chemical Name: 5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
CAS Number: 18593-44-7
Product Number: AG003MAA(AGN-PC-0JQPHU)
Synonyms:
MDL No:
Molecular Formula: C8H8N2OS
Molecular Weight: 180.2269

Identification/Properties


Properties
MP:
269-270℃ (ethanol )
BP:
428.3±45.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
180.225g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
180.036g/mol
Monoisotopic Mass:
180.036g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
241
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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