1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-7-methyl-


Chemical Name: 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-7-methyl-
CAS Number: 612-37-3
Product Number: AG0034EH(AGN-PC-09TCWH)
Synonyms:
MDL No:
Molecular Formula: C6H6N4O3
Molecular Weight: 182.1368

Identification/Properties


Properties
MP:
>300°C
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
182.139g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
182.044g/mol
Monoisotopic Mass:
182.044g/mol
Topological Polar Surface Area:
90.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
359
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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