Cilansetron
[CAS# 120635-74-7]

Identification

• Name: Cilansetron
• Synonyms: (-)-(R)-5,6,9,10-Tetrahydro-10-((2-Methylimidazol-1-Yl)Methyl)-4H-Pyrido(3,2,1-Jk)Carbazol-11(8H)-One; 4H-Pyrido(3,2,1-Jk)Carbazol-11(8H)-One, 5,6,9,10-Tetrahydro-10-((2-Methyl-1H-Imidazol-1-Yl)Methyl)-, (R)-; Cilansetron
• Molecular Formula: C₂₀H₂₁N₃O
• Molecular Weight: 319.41
• CAS Registry Number: 120635-74-7
• SMILES: C1=CC=C3C2=C1C4=C([N]2CCC3)CCC(C4=O)C[N]5C(=NC=C5)C
• InChI: 1S/C20H21N3O/c1-13-21-9-11-22(13)12-15-7-8-17-18(20(15)24)16-6-2-4-14-5-3-10-23(17)19(14)16/h2,4,6,9,11,15H,3,5,7-8,10,12H2,1H3
• InChIKey: NCNFDKWULDWJDS-UHFFFAOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 600.593°C at 760 mmHg (Cal.)
• Flash point: 317.028°C (Cal.)