4,6(1H,5H)-Pyrimidinedione, 5-methyl-


Chemical Name: 4,6(1H,5H)-Pyrimidinedione, 5-methyl-
CAS Number: 63447-38-1
Product Number: AG00ILPC(AGN-PC-07AAIY)
Synonyms:
MDL No:
Molecular Formula: C5H6N2O2
Molecular Weight: 126.1133

Identification/Properties


Properties
MP:
>300 °C(lit.)
BP:
327.4°C at 760 mmHg
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
126.115g/mol
XLogP3:
-0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
126.043g/mol
Monoisotopic Mass:
126.043g/mol
Topological Polar Surface Area:
61.7A^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:
Danger
UN#:
1759
Hazard Statements:
H318
Precautionary Statements:
P280-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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