8a-(4-Methylphenyl)-3,4,8,8a-Tetrahydro-2H-Pyrrolo[2,1-b][1,3]Oxazin-6(7H)-One
[CAS# 7088-17-7]

Identification

• Name: 8a-(4-Methylphenyl)-3,4,8,8a-Tetrahydro-2H-Pyrrolo[2,1-b][1,3]Oxazin-6(7H)-One
• Synonyms: 2H-Pyrrolo(2,1-B)(1,3)Oxazin-6-One, 3,4,6,7,8,8A-Hexahydro-8A-(P-Tolyl)-; 8A-(P-Tolyl)-3,4,6,7,8,8A-Hexahydro-2H-Pyrrolo(2,1-B)(1,3)Oxazin-6-One; Brn 1218004
• Molecular Formula: C₁₄H₁₇NO₂
• Molecular Weight: 231.29
• CAS Registry Number: 7088-17-7
• SMILES: C1=CC(=CC=C1C23OCCCN2C(CC3)=O)C
• InChI: 1S/C14H17NO2/c1-11-3-5-12(6-4-11)14-8-7-13(16)15(14)9-2-10-17-14/h3-6H,2,7-10H2,1H3
• InChIKey: WLZOVDLKCXHTKP-UHFFFAOYSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 401.005°C at 760 mmHg (Cal.)
• Flash point: 196.321°C (Cal.)