7,9-Dihydro-3H-Purine-2,6,8-Trithione
[CAS# 15986-33-1]

Identification

• Name: 7,9-Dihydro-3H-Purine-2,6,8-Trithione
• Synonyms: Nsc22718
• Molecular Formula: C₅H₄N₄S₃
• Molecular Weight: 216.29
• CAS Registry Number: 15986-33-1
• SMILES: C1(=S)NC(=S)NC2=C1NC(=S)N2
• InChI: 1S/C5H4N4S3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)
• InChIKey: ITERHBFDXIEMFW-UHFFFAOYSA-N

Properties

• Density: 1.8±0.1g/cm³ (Cal.)
• Melting point: 320°C (Expl.)
• Boiling point: 535.2±60.0°C at 760 mmHg (Cal.)
• Flash point: 277.5±32.9°C (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Irritates lungs, eyes, skin