6-Methyl-1,3-Dihydro-2H-Purine-2-Thione
[CAS# 1196-42-5]

Identification

• Name: 6-Methyl-1,3-Dihydro-2H-Purine-2-Thione
• Synonyms: 2-MERCAPTO-6-METHYLPURINE; 6-methyl mercaptopurine
• Molecular Formula: C₆H₆N₄S
• Molecular Weight: 166.20
• CAS Registry Number: 1196-42-5
• SMILES: Cc1nc(S)nc2ncnc12
• InChI: 1S/C6H6N4S/c1-3-4-5(8-2-7-4)10-6(11)9-3/h2H,1H3,(H2,7,8,9,10,11)
• InChIKey: RETZWTMHXMVXSV-UHFFFAOYSA-N

Properties

• Density: 1.505g/cm³ (Cal.)
• Boiling point: 513.668°C at 760 mmHg (Cal.)
• Flash point: 264.457°C (Cal.)
• Refractive index: 1.768 (Cal.)