10-[3-(Dimethylamino)Propyl]-2-Nitrodibenz[b,f][1,4]Oxazepin-11(10H)-One Monohydrochloride
[CAS# 16398-39-3]

Identification

• Name: 10-[3-(Dimethylamino)Propyl]-2-Nitrodibenz[b,f][1,4]Oxazepin-11(10H)-One Monohydrochloride
• Synonyms: Dimethyl-[3-(8-Nitro-6-Oxo-Benzo[B][1,4]Benzoxazepin-5-Yl)Propyl]Ammonium Chloride; Dimethyl-[3-(8-Nitro-6-Oxo-5-Benzo[B][1,4]Benzoxazepinyl)Propyl]Ammonium Chloride; 3-(6-Keto-8-Nitro-Benzo[B][1,4]Benzoxazepin-5-Yl)Propyl-Dimethyl-Ammonium Chloride
• Molecular Formula: C₁₈H₂₀ClN₃O₄
• Molecular Weight: 377.83
• CAS Registry Number: 16398-39-3
• EINECS: 240-449-1
• SMILES: C1=C([N+]([O-])=O)C=CC2=C1C(=O)N(C3=C(O2)C=CC=C3)CCC[NH+](C)C.[Cl-]
• InChI: 1S/C18H19N3O4.ClH/c1-19(2)10-5-11-20-15-6-3-4-7-17(15)25-16-9-8-13(21(23)24)12-14(16)18(20)22;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H
• InChIKey: QQYWZPWIDBROOG-UHFFFAOYSA-N

Properties

• Boiling point: 514.3°C at 760 mmHg (Cal.)
• Flash point: 264.8°C (Cal.)