6,7-Dihydro-9-Nitro-1-Phenyl-Pyrrolo(3,2,1-jk)(1,4)Benzodiazepin-4(3H)-One
[CAS# 28748-76-7]

Identification

• Name: 6,7-Dihydro-9-Nitro-1-Phenyl-Pyrrolo(3,2,1-jk)(1,4)Benzodiazepin-4(3H)-One
• Synonyms: 1,2-Dihydro-9-Nitro-7-Phenylpyrrolo(3,2,1-Jk)(1,4)Benzodiazepin-4(5H)-One; 6,7-Dihydro-9-Nitro-1-Phenylpyrrolo(3,2,1-Jk)(1,4)Benzodiazepin-4(3H)-One; Brn 0764186
• Molecular Formula: C₁₇H₁₃N₃O₃
• Molecular Weight: 307.31
• CAS Registry Number: 28748-76-7
• SMILES: C1=C3C2=C(C=C1[N+]([O-])=O)CCN2C(=O)CN=C3C4=CC=CC=C4
• InChI: 1S/C17H13N3O3/c21-15-10-18-16(11-4-2-1-3-5-11)14-9-13(20(22)23)8-12-6-7-19(15)17(12)14/h1-5,8-9H,6-7,10H2
• InChIKey: YEGPAECQRYOKHX-UHFFFAOYSA-N

Properties

• Density: 1.461g/cm³ (Cal.)
• Boiling point: 538.974°C at 760 mmHg (Cal.)
• Flash point: 279.762°C (Cal.)