5-Thia-3,9-diazatricyclo[6.3.1.0^2,6]dodeca-1,3,6,8,10-pentaene
[CAS# 79632-36-3]

Identification

• Name: 5-Thia-3,9-diazatricyclo[6.3.1.0^2,6]dodeca-1,3,6,8,10-pentaene
• Molecular Formula: C₉H₆N₂S
• Molecular Weight: 174.22
• CAS Registry Number: 79632-36-3
• SMILES: C1C2=C3C(=CC1=NC=C2)SC=N3
• InChI: 1S/C9H6N2S/c1-2-10-7-3-6(1)9-8(4-7)12-5-11-9/h1-2,4-5H,3H2
• InChIKey: MBXYABJBIKPRQP-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 325.8±52.0°C at 760 mmHg (Cal.)
• Flash point: 150.8±30.7°C (Cal.)