6-Amino-2,4(3H,5H)-Pyrimidinedione
[CAS# 14436-34-1]

Identification

• Name: 6-Amino-2,4(3H,5H)-Pyrimidinedione
• Synonyms: 6-Amino-5H-Pyrimidine-2,4-Quinone; 2,4(3H,5H)-Pyrimidinedione, 6-Amino- (9Ci); 2,4-Dihydroxy-6-Aminopyrimidine
• Molecular Formula: C₄H₅N₃O₂
• Molecular Weight: 127.10
• CAS Registry Number: 14436-34-1
• SMILES: O=C1NC(=O)CC(=N1)N
• InChI: 1S/C4H5N3O2/c5-2-1-3(8)7-4(9)6-2/h1H2,(H3,5,6,7,8,9)
• InChIKey: BLOCGUWRFAOSFW-UHFFFAOYSA-N

Properties

• Density: 1.844g/cm³ (Cal.)

References

• (1): G. Ferguson, J. F. Gallagher, J. N. Low, R. A. Howie, F. Hueso-Urena and M. N. Moreno Carretero. Intermolecular N-HO=C hydrogen bonding in the crystal structure of 6-amino-1,3-dimethyluracil, Acta Cryst. (1993). C49, 2162-2164