2-Mercaptopurine-6,8-Diol
[CAS# 15986-31-9]

Identification

• Name: 2-Mercaptopurine-6,8-Diol
• Synonyms: 2-Thioxo-7,9-Dihydro-3H-Purine-6,8-Dione; 2-Thioxo-7,9-Dihydro-3H-Purine-6,8-Quinone; Nsc22716
• Molecular Formula: C₅H₄N₄O₂S
• Molecular Weight: 184.17
• CAS Registry Number: 15986-31-9
• EINECS: 240-119-7
• SMILES: O=C1NC(=S)NC2=C1NC(N2)=O
• InChI: 1S/C5H4N4O2S/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)
• InChIKey: JDAXHCJXSLHZAG-UHFFFAOYSA-N

Properties

• Density: 1.881g/cm³ (Cal.)