6,11-Dihydro-5-Methyl-11-Oxo-5H-Dibenz[b,e]Azepine-2-Acetic Acid
[CAS# 68787-95-1]

Identification

• Name: 6,11-Dihydro-5-Methyl-11-Oxo-5H-Dibenz[b,e]Azepine-2-Acetic Acid
• Synonyms: 2-(11-Keto-5-Methyl-6H-Benzo[C][2]Benzazepin-2-Yl)Acetic Acid; 2-(5-Methyl-11-Oxo-6H-Benzo[C][2]Benzazepin-2-Yl)Ethanoic Acid; 6,11-Dihydro-5-Methyl-11-Oxo-5H-Dibenz(B,E)Azepine-2-Acetic Acid
• Molecular Formula: C₁₇H₁₅NO₃
• Molecular Weight: 281.31
• CAS Registry Number: 68787-95-1
• SMILES: C1=C(C=CC2=C1C(=O)C3=C(CN2C)C=CC=C3)CC(=O)O
• InChI: 1S/C17H15NO3/c1-18-10-12-4-2-3-5-13(12)17(21)14-8-11(9-16(19)20)6-7-15(14)18/h2-8H,9-10H2,1H3,(H,19,20)
• InChIKey: KJYXUANTSFDCOA-UHFFFAOYSA-N

Properties

• Density: 1.286g/cm³ (Cal.)
• Boiling point: 546.729°C at 760 mmHg (Cal.)
• Flash point: 284.452°C (Cal.)