4-(3-Bromophenyl)-1,3-dihydro-2H-1,5-benzodiazepine-2-thione
[CAS# 85741-21-5]

Identification

• Name: 4-(3-Bromophenyl)-1,3-dihydro-2H-1,5-benzodiazepine-2-thione
• Synonyms: 4-(3-bromophenyl)-1,3-dihydro-2H-1,5-benzodiazepin-2-thione; 4-Bdbdt
• Molecular Formula: C₁₅H₁₁BrN₂S
• Molecular Weight: 331.23
• CAS Registry Number: 85741-21-5
• SMILES: Brc3cccc(\C2=N\c1ccccc1NC(=S)C2)c3
• InChI: 1S/C15H11BrN2S/c16-11-5-3-4-10(8-11)14-9-15(19)18-13-7-2-1-6-12(13)17-14/h1-8H,9H2,(H,18,19)
• InChIKey: WKLCRCKTSIBQSL-UHFFFAOYSA-N

Properties

• Density: 1.511g/cm³ (Cal.)
• Boiling point: 434.661°C at 760 mmHg (Cal.)
• Flash point: 216.675°C (Cal.)