IUPAC Name: N-[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-N-methylnitrous amide
Synonyms of N-Methyl-N-nitrosoadenine (CAS NO.21928-82-5): 1H-Purin-6-amine, N(sup 6)-methyl-N(sup 6)-nitroso- ; 1H-Purin-6-amine, N-methyl-N-nitroso- ; 6-(Methylnitrosamino)purine ; 6-Mna ; N(6)-(Methylnitroso)adenosine ; N-Methyl-N-nitroso-1H-purin-6-amine ; Adenine, N-methyl-N-nitroso-
CAS NO: 21928-82-5
Molecular Formula of N-Methyl-N-nitrosoadenine (CAS NO.21928-82-5): C11H14N6O5
Molecular Weight: 310.2661
H bond acceptors: 11
H bond donors: 3
Freely Rotating Bonds: 7
Polar Surface Area: 113.19 Å2
Index of Refraction: 1.835
Molar Refractivity: 70.33 cm3
Molar Volume: 159.3 cm3
Surface Tension: 94 dyne/cm
Density of N-Methyl-N-nitrosoadenine (CAS NO.21928-82-5): 1.94 g/cm3
Flash Point: 378.8 °C
Enthalpy of Vaporization: 108 kJ/mol
Boiling Point: 702.8 °C at 760 mmHg
Vapour Pressure: 9.9E-21 mmHg at 25°C
Molecular Structure:
Questionable carcinogen with experimental carcinogenic and neoplastigenic data. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.
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