5-Thia-8-Azatricyclo[6.2.1.0^2,6]Undeca-1,3,6,9-Tetraene
[CAS# 484032-36-2]

Identification

• Name: 5-Thia-8-Azatricyclo[6.2.1.0^2,6]Undeca-1,3,6,9-Tetraene
• Synonyms: 4,7-methanothieno[2,3-c]azepine
• Molecular Formula: C₉H₇NS
• Molecular Weight: 161.22
• CAS Registry Number: 484032-36-2
• SMILES: c1csc2=CN3CC(=c21)C=C3
• InChI: 1S/C9H7NS/c1-3-10-5-7(1)8-2-4-11-9(8)6-10/h1-4,6H,5H2
• InChIKey: IJLQMYAXILQOIB-UHFFFAOYSA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 413.44°C at 760 mmHg (Cal.)
• Flash point: 203.842°C (Cal.)
• Refractive index: 1.787 (Cal.)