3-Oxa-9-Thia-4-Azatricyclo[5.2.2.0^2,6]Undeca-1,5,7-Triene
[CAS# 132804-43-4]

Identification

• Name: 3-Oxa-9-Thia-4-Azatricyclo[5.2.2.0^2,6]Undeca-1,5,7-Triene
• Synonyms: 5,6-dihydro-2H-7,4-(epithiometheno)benzo[d]isoxazole
• Molecular Formula: C₈H₇NOS
• Molecular Weight: 165.21
• CAS Registry Number: 132804-43-4
• SMILES: C1CC2=C3C(=CNO3)C1=CS2
• InChI: 1S/C8H7NOS/c1-2-7-8-6(3-9-10-8)5(1)4-11-7/h3-4,9H,1-2H2
• InChIKey: GWCXXQGLRDLNPG-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 371.0±35.0°C at 760 mmHg (Cal.)
• Flash point: 178.2±25.9°C (Cal.)
• Refractive index: 1.738 (Cal.)