4'-Fluoro-gamma-[4-(2-Methylthio-1H-Benzimidazol-1-Yl)Piperidino]Butyrophenone
[CAS# 57648-22-3]

Identification

• Name: 4'-Fluoro-gamma-[4-(2-Methylthio-1H-Benzimidazol-1-Yl)Piperidino]Butyrophenone
• Synonyms: 1-(4-Fluorophenyl)-4-[4-(2-Methylsulfanylbenzimidazol-1-Yl)-1-Piperidyl]Butan-1-One; 1-(4-Fluorophenyl)-4-[4-[2-(Methylthio)-1-Benzimidazolyl]-1-Piperidinyl]Butan-1-One; 1-(4-Fluorophenyl)-4-[4-[2-(Methylthio)Benzimidazol-1-Yl]-1-Piperidyl]Butan-1-One
• Molecular Formula: C₂₃H₂₆FN₃OS
• Molecular Weight: 411.54
• CAS Registry Number: 57648-22-3
• SMILES: C1=CC=CC4=C1[N](C2CCN(CC2)CCCC(C3=CC=C(C=C3)F)=O)C(=N4)SC
• InChI: 1S/C23H26FN3OS/c1-29-23-25-20-5-2-3-6-21(20)27(23)19-12-15-26(16-13-19)14-4-7-22(28)17-8-10-18(24)11-9-17/h2-3,5-6,8-11,19H,4,7,12-16H2,1H3
• InChIKey: BVGPDNRHQWKRSI-UHFFFAOYSA-N

Properties

• Density: 1.252g/cm³ (Cal.)
• Boiling point: 599.894°C at 760 mmHg (Cal.)
• Flash point: 316.605°C (Cal.)