(3aR,7aS)-7A-Methylhexahydro-1,3-Benzoxazol-2(3H)-One
[CAS# 116535-52-5]

Identification

• Name: (3aR,7aS)-7A-Methylhexahydro-1,3-Benzoxazol-2(3H)-One
• Synonyms: (3aR,7aS)-7a-methylhexahydrobenzo[d]oxazol-2(3H)-one
• Molecular Formula: C₈H₁₃NO₂
• Molecular Weight: 155.19
• CAS Registry Number: 116535-52-5
• SMILES: C[C@]12CCCC[C@H]1NC(=O)O2
• InChI: 1S/C8H13NO2/c1-8-5-3-2-4-6(8)9-7(10)11-8/h6H,2-5H2,1H3,(H,9,10)/t6-,8+/m1/s1
• InChIKey: FBVZZXGFPMYONR-SVRRBLITSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 332.3±9.0°C at 760 mmHg (Cal.)
• Flash point: 154.8±18.7°C (Cal.)
• Refractive index: 1.488 (Cal.)