(3aS,3bS,6aS)-3,3A,3B,4,5,6,6A,7-Octahydropentaleno[2,1-c][1,2]Oxazole
[CAS# 155687-96-0]

Identification

• Name: (3aS,3bS,6aS)-3,3A,3B,4,5,6,6A,7-Octahydropentaleno[2,1-c][1,2]Oxazole
• Synonyms: (3aS,3bS,6aS)-3,3a,3b,4,5,6,6a,7-octahydropentaleno[2,1-c]isoxazole
• Molecular Formula: C₉H₁₃NO
• Molecular Weight: 151.21
• CAS Registry Number: 155687-96-0
• SMILES: C1C[C@H]2CC3=NOC[C@H]3[C@H]2C1
• InChI: 1S/C9H13NO/c1-2-6-4-9-8(5-11-10-9)7(6)3-1/h6-8H,1-5H2/t6-,7-,8-/m0/s1
• InChIKey: QHGBBHKQUOKFKZ-FXQIFTODSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 227.1±23.0°C at 760 mmHg (Cal.)
• Flash point: 77.1±15.1°C (Cal.)
• Refractive index: 1.724 (Cal.)