2,8-Dinitroimipramine
[CAS# 80186-88-5]

Identification

• Name: 2,8-Dinitroimipramine
• Synonyms: 3-(3,8-Dinitro-5,6-Dihydrobenzo[B][1]Benzazepin-11-Yl)-N,N-Dimethyl-Propan-1-Amine; 3-(3,8-Dinitro-5,6-Dihydrobenzo[B][1]Benzazepin-11-Yl)Propyl-Dimethyl-Amine; Nci60_040318
• Molecular Formula: C₁₉H₂₂N₄O₄
• Molecular Weight: 370.41
• CAS Registry Number: 80186-88-5
• SMILES: C2=C1N(C3=C(CCC1=CC(=C2)[N+]([O-])=O)C=C([N+]([O-])=O)C=C3)CCCN(C)C
• InChI: 1S/C19H22N4O4/c1-20(2)10-3-11-21-18-8-6-16(22(24)25)12-14(18)4-5-15-13-17(23(26)27)7-9-19(15)21/h6-9,12-13H,3-5,10-11H2,1-2H3
• InChIKey: MKXUVDRBPODBNG-UHFFFAOYSA-N

Properties

• Density: 1.265g/cm³ (Cal.)
• Boiling point: 549.759°C at 760 mmHg (Cal.)
• Flash point: 286.284°C (Cal.)