6H-Purin-6-one, 2-amino-1,7-dihydro-8-nitro-


Chemical Name: 6H-Purin-6-one, 2-amino-1,7-dihydro-8-nitro-
CAS Number: 168701-80-2
Product Number: AG001Y8L(AGN-PC-0O4RZN)
Synonyms:
MDL No: MFCD02259372
Molecular Formula: C5H4N6O3
Molecular Weight: 196.1237

Identification/Properties


Properties
MP:
>260°C (dec.)
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
196.126g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
196.034g/mol
Monoisotopic Mass:
196.034g/mol
Topological Polar Surface Area:
142A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
322
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

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NMR Spectrum


Other Analytical Data


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