1,4-Bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline

Base Information

• Chemical Name: 1,4-Bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline
• CAS No.: 7151-43-1
• Molecular Formula: C₂₀H₁₈N₂O₄S₂
• Molecular Weight: 414.506
• NSC Number: 70127
• DSSTox Substance ID: DTXSID00290641
• Wikidata: Q82028393
• Pharos Ligand ID: TX92KWSLR1YF
• ChEMBL ID: CHEMBL1570894
• Mol file: 7151-43-1.mol

Synonyms:NSC70127;7151-43-1;MLS002693676;NSC-70127;1,4-bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline;NCIStruc1_001526;NCIStruc2_001432;CHEMBL1570894;DTXSID00290641;HMS3086O21;NCI70127;CCG-37217;NCGC00013783;NCGC00013783-02;NCGC00096893-01;NCI60_036397;SMR001559621

Chemical Property of 1,4-Bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline

Chemical Property:

• Vapor Pressure: 3.55E-14mmHg at 25°C
• Boiling Point: 596.1°C at 760 mmHg
• Flash Point: 314.3°C
• Density: 1.415g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 414.07079941
• Heavy Atom Count: 28
• Complexity: 665

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(C2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Technology Process of 1,4-Bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline

There total 2 articles about 1,4-Bis(phenylsulfonyl)-1,2,3,4-tetrahydroquinoxaline 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:

1,2,3,4-tetrahydroquinoxaline (3476-89-9) + benzenesulfonyl chloride (98-09-9) → 1,4-bis-benzenesulfonyl-1,2,3,4-tetrahydro-quinoxaline (7151-43-1)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01196a015

Reference yield:

ethylene dibromide (106-93-4) → 1,4-bis-benzenesulfonyl-1,2,3,4-tetrahydro-quinoxaline (7151-43-1)

Guidance literature:

With sodium ethanolate;

upstream raw materials:

1,2,3,4-tetrahydroquinoxaline

benzenesulfonyl chloride

ethylene dibromide