1-[(4-Bromophenyl)Sulfonyl]-1H-Azepine
[CAS# 20646-55-3]

Identification

• Name: 1-[(4-Bromophenyl)Sulfonyl]-1H-Azepine
• Synonyms: 1-[(4-Bromophenyl)sulfonyl]-1H-azepine #
• Molecular Formula: C₁₂H₁₀BrNO₂S
• Molecular Weight: 312.18
• CAS Registry Number: 20646-55-3
• SMILES: O=S(=O)(c1ccc(Br)cc1)N\2/C=C\C=C/C=C/2
• InChI: 1S/C12H10BrNO2S/c13-11-5-7-12(8-6-11)17(15,16)14-9-3-1-2-4-10-14/h1-10H
• InChIKey: BFPNXVJVHFBCGA-UHFFFAOYSA-N

Properties

• Density: 1.572g/cm³ (Cal.)
• Boiling point: 434.189°C at 760 mmHg (Cal.)
• Flash point: 216.39°C (Cal.)
• Refractive index: 1.652 (Cal.)