(5E)-5-(5-Oxo-6H-Pyrido[4,3-c][1]Benzazepin-11-Ylidene)Pentanoic Acid
[CAS# 127653-90-1]

Identification

• Name: (5E)-5-(5-Oxo-6H-Pyrido[4,3-c][1]Benzazepin-11-Ylidene)Pentanoic Acid
• Synonyms: (5E)-5-(5-Keto-6H-Pyrido[4,3-C][1]Benzazepin-11-Ylidene)Valeric Acid; Pentanoic Acid, 5-(5,6-Dihydro-5-Oxo-11H-Pyrido(4,3-C)(1)Benzazepin-11-Ylidene)-; 11-(4-Carboxypentylidene)-5,11-Dihydropyrido(4,3-C)(1)Benzazepin-5(6H)-One
• Molecular Formula: C₁₈H₁₆N₂O₃
• Molecular Weight: 308.34
• CAS Registry Number: 127653-90-1
• SMILES: C3=C2\C(C1=CC=CC=C1NC(=O)C2=CC=N3)=C\CCCC(=O)O
• InChI: 1S/C18H16N2O3/c21-17(22)8-4-2-5-12-13-6-1-3-7-16(13)20-18(23)14-9-10-19-11-15(12)14/h1,3,5-7,9-11H,2,4,8H2,(H,20,23)(H,21,22)/b12-5+
• InChIKey: OHOKOCUYERJWFG-LFYBBSHMSA-N

Properties

• Density: 1.335g/cm³ (Cal.)
• Boiling point: 485.81°C at 760 mmHg (Cal.)
• Flash point: 247.609°C (Cal.)