6-(Phenyldithio)Purine
[CAS# 2958-91-0]

Identification

• Name: 6-(Phenyldithio)Purine
• Synonyms: 1H-Purine, 6-(Phenyldithio)-; 6-(Phenyldithio)Purine
• Molecular Formula: C₁₁H₈N₄S₂
• Molecular Weight: 260.33
• CAS Registry Number: 2958-91-0
• SMILES: C1=NC2=C([NH]1)C(=NC=N2)SSC3=CC=CC=C3
• InChI: 1S/C11H8N4S2/c1-2-4-8(5-3-1)16-17-11-9-10(13-6-12-9)14-7-15-11/h1-7H,(H,12,13,14,15)
• InChIKey: WQJKHMQINFOCJI-UHFFFAOYSA-N

Properties

• Density: 1.526g/cm³ (Cal.)
• Boiling point: 520.167°C at 760 mmHg (Cal.)
• Flash point: 268.387°C (Cal.)