8-Hydroxyondansetron

Base Information

• Chemical Name: 8-Hydroxyondansetron
• CAS No.: 126671-71-4
• Molecular Formula: C₁₈H₁₉N₃O₂
• Molecular Weight: 309.368
• UNII: 20UA9420EZ
• DSSTox Substance ID: DTXSID80599407
• Nikkaji Number: J478.046I
• Wikidata: Q27253483
• Mol file: 126671-71-4.mol

Synonyms:8-hydroxyondansetron

Chemical Property of 8-Hydroxyondansetron

Chemical Property:

• Vapor Pressure: 4.16E-15mmHg at 25°C
• Boiling Point: 602.4°C at 760 mmHg
• Flash Point: 318.1°C
• PSA: 60.05000
• Density: 1.36g/cm³
• LogP: 2.83410
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 309.147726857
• Heavy Atom Count: 23
• Complexity: 471

Purity/Quality:

98%Min ^*data from raw suppliers

8-HYDROXY ONDANSETRON 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=CN1CC2CCC3=C(C2=O)C4=C(N3C)C(=CC=C4)O
• Uses: A metabolite of Ondansetron (O655005) . Ondansetron is a specific serotonin (5-HT3) receptor antagonist. Antiemetic.

Technology Process of 8-Hydroxyondansetron

There total 1 articles about 8-Hydroxyondansetron which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

ondanserton (99614-02-5,99614-58-1,99614-60-5,116002-70-1) → 1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazolyl-1-yl)methyl]-4H-carbazol-4-one (99614-14-9) + 7-Hydroxyondansetron + 8-Hydroxyondansetron (126671-71-4)

Guidance literature:

With NADPH-regenerating system; magnesium chloride; rat hepatic microsome; In phosphate buffer; at 37 ℃; pH=7.4; Further Variations:; Reagents; Enzyme kinetics;

DOI:10.3109/00498259609052492

upstream raw materials:

ondanserton