1H-Pyrimido[1,2-a]Purin-10-One
[CAS# 103408-45-3]

Identification

• Name: 1H-Pyrimido[1,2-a]Purin-10-One
• Synonyms: Guanine-Malondialdehyde Adduct; Pyrimido(1,2-A)Purin-10(1H)-One
• Molecular Formula: C₈H₅N₅O
• Molecular Weight: 187.16
• CAS Registry Number: 103408-45-3
• SMILES: C1=NC2=C([NH]1)C(N3C(=N2)N=CC=C3)=O
• InChI: 1S/C8H5N5O/c14-7-5-6(11-4-10-5)12-8-9-2-1-3-13(7)8/h1-4H,(H,10,11)
• InChIKey: ZREGNVKUSNORFO-UHFFFAOYSA-N

Properties

• Density: 1.822g/cm³ (Cal.)
• Boiling point: 561.474°C at 760 mmHg (Cal.)
• Flash point: 293.369°C (Cal.)