1-(4-Fluorophenyl)-4-[4-(3-isoquinolyl)-1-piperazinyl]butan-1-one hydrochloride
[CAS# 82117-52-0]

Identification

• Name: 1-(4-Fluorophenyl)-4-[4-(3-isoquinolyl)-1-piperazinyl]butan-1-one hydrochloride
• Synonyms: 1-(4-Fluorophenyl)-4-[4-(3-Isoquinolyl)Piperazin-1-Yl]Butan-1-One Hydrochloride; 1-(4-Fluorophenyl)-4-[4-(3-Isoquinolyl)-1-Piperazinyl]Butan-1-One Hydrochloride; Nsc355502
• Molecular Formula: C₂₃H₂₅ClFN₃O
• Molecular Weight: 413.92
• CAS Registry Number: 82117-52-0
• SMILES: [H+].C3=C(N1CCN(CC1)CCCC(=O)C2=CC=C(F)C=C2)N=CC4=CC=CC=C34.[Cl-]
• InChI: 1S/C23H24FN3O.ClH/c24-21-9-7-18(8-10-21)22(28)6-3-11-26-12-14-27(15-13-26)23-16-19-4-1-2-5-20(19)17-25-23;/h1-2,4-5,7-10,16-17H,3,6,11-15H2;1H
• InChIKey: JZTJTZLBUIZNCX-UHFFFAOYSA-N

Properties

• Boiling point: 576.9°C at 760 mmHg (Cal.)
• Flash point: 302.7°C (Cal.)