Batoprazine

Base Information

• Chemical Name: Batoprazine
• CAS No.: 105685-11-8
• Molecular Formula: C₁₃H₁₄N₂O₂
• Molecular Weight: 230.266
• Hs Code.: 2934999090
• UNII: EZY3PL8Q0M
• DSSTox Substance ID: DTXSID70147254
• Nikkaji Number: J561.841J
• Wikipedia: Batoprazine
• Wikidata: Q4869511
• NCI Thesaurus Code: C73283
• ChEMBL ID: CHEMBL2104650
• Mol file: 105685-11-8.mol

Synonyms:Batoprazine;105685-11-8;8-piperazin-1-ylchromen-2-one;Batoprazine [INN];UNII-EZY3PL8Q0M;8-(1-Piperazinyl)coumarin;EZY3PL8Q0M;SCHEMBL766463;N-(coumarin-8-yl)-piperazine;CHEMBL2104650;DTXSID70147254;Q4869511

Chemical Property of Batoprazine

Chemical Property:

• Vapor Pressure: 1.66E-08mmHg at 25°C
• Boiling Point: 456.2°C at 760 mmHg
• Flash Point: 229.7°C
• PSA: 45.48000
• Density: 1.241g/cm³
• LogP: 1.59640
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 230.105527694
• Heavy Atom Count: 17
• Complexity: 323

Purity/Quality:

99.0%min ^*data from raw suppliers

BATOPRAZINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)C2=CC=CC3=C2OC(=O)C=C3

Technology Process of Batoprazine

There total 1 articles about Batoprazine 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:

8-aminocoumarin (75487-97-7) → N-(coumarin-8-yl)-piperazine (105685-11-8)

Guidance literature:

potassium iodide; potassium carbonate; In chlorobenzene;

upstream raw materials:

8-aminocoumarin

Refernces