(11aS)-2,3-Dihydro-1H-Pyrrolo[2,1-c][1,4]Benzodiazepine-5,11(10H,11aH)-Dione
[CAS# 18877-34-4]

Identification

• Name: (11aS)-2,3-Dihydro-1H-Pyrrolo[2,1-c][1,4]Benzodiazepine-5,11(10H,11aH)-Dione
• Synonyms: (11aS)-10H-benzo[f]pyrrolidino[2,1-c]1,4-diazepine-5,11-dione; (S)-1,2,3,11a-Tetrahydro-10H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11-dione; (S)-2,3-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H,11aH)-dione
• Molecular Formula: C₁₂H₁₂N₂O₂
• Molecular Weight: 216.24
• CAS Registry Number: 18877-34-4
• SMILES: C1C[C@H]2C(=O)NC3=CC=CC=C3C(=O)N2C1
• InChI: 1S/C12H12N2O2/c15-11-10-6-3-7-14(10)12(16)8-4-1-2-5-9(8)13-11/h1-2,4-5,10H,3,6-7H2,(H,13,15)/t10-/m0/s1
• InChIKey: MXBNEEHQIDLPLQ-JTQLQIEISA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 477.4±34.0°C at 760 mmHg (Cal.)
• Flash point: 242.5±25.7°C (Cal.)
• Refractive index: 1.649 (Cal.)