(3S,7alphaR)-Tetrahydro-7alpha-Methyl-3-Phenyl-Pyrrolo[2,1-b]Oxazol-5(6H)-One
[CAS# 153745-22-3]

Identification

• Name: (3S,7alphaR)-Tetrahydro-7alpha-Methyl-3-Phenyl-Pyrrolo[2,1-b]Oxazol-5(6H)-One
• Synonyms: (3S,7Ar)-7A-Methyl-3-Phenyl-2,3,6,7-Tetrahydropyrrolo[5,1-B]Oxazol-5-One; Zinc01081375
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.27
• CAS Registry Number: 153745-22-3
• SMILES: [C@@]12(OC[C@@H](N1C(=O)CC2)C3=CC=CC=C3)C
• InChI: 1S/C13H15NO2/c1-13-8-7-12(15)14(13)11(9-16-13)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3/t11-,13-/m1/s1
• InChIKey: JVEHIYMWPAQEIR-DGCLKSJQSA-N

Properties

• Density: 1.218g/cm³ (Cal.)
• Boiling point: 374.513°C at 760 mmHg (Cal.)
• Flash point: 180.299°C (Cal.)