5,6,7,8-Tetrahydro-2H-Isoxazolo[4,5-d]Azepin-3(4H)-One
[CAS# 53658-58-5]

Identification

• Name: 5,6,7,8-Tetrahydro-2H-Isoxazolo[4,5-d]Azepin-3(4H)-One
• Synonyms: 5,6,7,8-Tetrahydro-4H-Isoxazolo[4,5-D]Azepin-3-One; 2H-Isoxazolo(4,5-D)Azepin-3(4H)-One, 5,6,7,8-Tetrahydro-; 5,6,7,8-Tetrahydro-2H-Isoxazolo(4,5-D)Azepin-3(4H)-One
• Molecular Formula: C₇H₁₀N₂O₂
• Molecular Weight: 154.17
• CAS Registry Number: 53658-58-5
• SMILES: O=C1NOC2=C1CCNCC2
• InChI: 1S/C7H10N2O2/c10-7-5-1-3-8-4-2-6(5)11-9-7/h8H,1-4H2,(H,9,10)
• InChIKey: KHTRGFVHYPWHIZ-UHFFFAOYSA-N

Properties

• Density: 1.294g/cm³ (Cal.)
• Boiling point: 354.9°C at 760 mmHg (Cal.)
• Flash point: 168.4°C (Cal.)