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2-Nitro-1H-Purin-6-Amine
[CAS# 501950-35-2]

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Identification
Name 2-Nitro-1H-Purin-6-Amine
Synonyms 1H-Purin-6-amine, 2-nitro-; 2-nitro-1H-purin-6-amine
Molecular Structure CAS#: 501950-35-2, 2-Nitro-1H-Purin-6-Amine
Molecular Formula C5H4N6O2
Molecular Weight 180.12
CAS Registry Number 501950-35-2
SMILES c1[nH]c2c(nc(nc2n1)[N+](=O)[O-])N
InChI 1S/C5H4N6O2/c6-3-2-4(8-1-7-2)10-5(9-3)11(12)13/h1H,(H3,6,7,8,9,10)
InChIKey NVIATZSDAYSNSB-UHFFFAOYSA-N
Properties
Density 1.883g/cm3 (Cal.)
Boiling point 792.88°C at 760 mmHg (Cal.)
Flash point 433.318°C (Cal.)
Refractive index 1.874 (Cal.)
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