Centphenaquin
[CAS# 98459-16-6]

Identification

• Name: Centphenaquin
• Synonyms: 11-(4-Phenyl-1-Piperazinyl)-7,8,9,10-Tetrahydro-6H-Cyclohepta[B]Quinoline Dihydrochloride; 6H-Cyclohepta(B)Quinoline, 7,8,9,10-Tetrahydro-11-(4-Phenyl-1-Piperazinyl)-, Dihydrochloride; 7,8,9,10-Tetrahydro-11-(4-Phenyl-1-Piperazinyl)-6H-Cyclohepta(B)Quinolin
• Molecular Formula: C₂₄H₂₉Cl₂N₃
• Molecular Weight: 430.42
• CAS Registry Number: 98459-16-6
• SMILES: [H+].[H+].C3=C2C(=C1CCCCCC1=NC2=CC=C3)N4CCN(CC4)C5=CC=CC=C5.[Cl-].[Cl-]
• InChI: 1S/C24H27N3.2ClH/c1-3-9-19(10-4-1)26-15-17-27(18-16-26)24-20-11-5-2-6-13-22(20)25-23-14-8-7-12-21(23)24;;/h1,3-4,7-10,12,14H,2,5-6,11,13,15-18H2;2*1H
• InChIKey: NCTHSHSIWQKXLV-UHFFFAOYSA-N

Properties

• Boiling point: 581.1°C at 760 mmHg (Cal.)
• Flash point: 305.2°C (Cal.)