3-Isocyanato-4,5,6,7-Tetrahydro-1,2-Benzoxazole
[CAS# 55809-61-5]

Identification

• Name: 3-Isocyanato-4,5,6,7-Tetrahydro-1,2-Benzoxazole
• Synonyms: 3-isocyanato-4,5,6,7-tetrahydrobenzo[d]isoxazole
• Molecular Formula: C₈H₈N₂O₂
• Molecular Weight: 164.16
• CAS Registry Number: 55809-61-5
• SMILES: C1CCC2=C(C1)C(=NO2)N=C=O
• InChI: 1S/C8H8N2O2/c11-5-9-8-6-3-1-2-4-7(6)12-10-8/h1-4H2
• InChIKey: LPGORFQRWFQKPO-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 321.5±42.0°C at 760 mmHg (Cal.)
• Flash point: 148.2±27.9°C (Cal.)