1,2,3,7-Tetrahydro-3-Hydroxy-2-Imino-1-Methyl-6H-Purin-6-One
[CAS# 63885-07-4]

Identification

• Name: 1,2,3,7-Tetrahydro-3-Hydroxy-2-Imino-1-Methyl-6H-Purin-6-One
• Synonyms: 1-Methylguanine-3-Oxide; 6H-Purin-6-One, 2-Amino-1,7-Dihydro-1-Methyl-, 3-Oxide; 3-Hydroxy-1-Methylguanine
• Molecular Formula: C₆H₇N₅O₂
• Molecular Weight: 181.15
• CAS Registry Number: 63885-07-4
• SMILES: C1=NC2=C([NH]1)C(N(C(N2O)=N)C)=O
• InChI: 1S/C6H7N5O2/c1-10-5(12)3-4(9-2-8-3)11(13)6(10)7/h2,7,13H,1H3,(H,8,9)
• InChIKey: DQIIPZOYVYHCGT-UHFFFAOYSA-N

Properties

• Density: 1.935g/cm³ (Cal.)
• Boiling point: 509.091°C at 760 mmHg (Cal.)
• Flash point: 261.689°C (Cal.)