4-Amino-2(1H)-pyrimidinone
[CAS# 66460-21-7]

Identification

• Name: 4-Amino-2(1H)-pyrimidinone
• Synonyms: 2 (1H)-Pyrimidinone, 4-amino-; 2(1H)-Pyrimidinone, 4-amino- (9CI); 2-oxy-4-amino pyrimidine
• Molecular Formula: C₄H₅N₃O
• Molecular Weight: 111.10
• CAS Registry Number: 66460-21-7
• SMILES: C1=CNC(=O)N=C1N
• InChI: 1S/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)
• InChIKey: OPTASPLRGRRNAP-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Melting point: 300°C (Expl.)
• Flash point: 110°C (Expl.)

Safety Data

• Safety Code: S26;S37;S60
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Not sold for human treatment, trials or use

References

• (1): Hong-Ke Liu, John A. Parkinson, Juraj Bella, Fuyi Wang and Peter J. Sadler. Penetrative DNA intercalation and G-base selectivity of an organometallic tetrahydroanthracene Ru anticancer complex, Chem. Sci., 2010, 1, 258.