5,6,7,8,9,10-Hexahydro-4-(3-Chlorophenyl)-4H-(1)Benzothieno(3,2-f)Pyrrolo(1,2-A)(1,4)Diazepine
[CAS# 126684-59-1]

Identification

• Name: 5,6,7,8,9,10-Hexahydro-4-(3-Chlorophenyl)-4H-(1)Benzothieno(3,2-f)Pyrrolo(1,2-A)(1,4)Diazepine
• Molecular Formula: C₂₀H₁₉ClN₂S
• Molecular Weight: 354.90
• CAS Registry Number: 126684-59-1
• SMILES: C1=CC=C4[N]1C2=C(C3=C(S2)CCCC3)CNC4C5=CC=CC(=C5)Cl
• InChI: 1S/C20H19ClN2S/c21-14-6-3-5-13(11-14)19-17-8-4-10-23(17)20-16(12-22-19)15-7-1-2-9-18(15)24-20/h3-6,8,10-11,19,22H,1-2,7,9,12H2
• InChIKey: ACMUPPDDQFBFEE-UHFFFAOYSA-N

Properties

• Density: 1.413g/cm³ (Cal.)
• Boiling point: 536.947°C at 760 mmHg (Cal.)
• Flash point: 278.536°C (Cal.)