6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline

Base Information

• Chemical Name: 6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline
• CAS No.: 96793-51-0
• Molecular Formula: C₁₄H₁₃N₃
• Molecular Weight: 223.277
• DSSTox Substance ID: DTXSID10704461
• Mol file: 96793-51-0.mol

Synonyms:96793-51-0;6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline;7,8,9,10-Tetrahydro-6H-Indolo[2,3-b]quinoxaline;DTXSID10704461;FT-0739536;6a,7,8,9,10,10a-hexahydro-6H-indolo[3,2-b]quinoxaline

Chemical Property of 6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline

Chemical Property:

• Melting Point: >300 °C(Solv: ethanol (64-17-5); water (7732-18-5))
• Boiling Point: 419.1±28.0 °C(Predicted)
• PKA: 8.19±0.20(Predicted)
• PSA: 37.81000
• Density: 1.41±0.1 g/cm3(Predicted)
• LogP: 3.21950
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 225.126597491
• Heavy Atom Count: 17
• Complexity: 293

Purity/Quality:

97% ^*data from raw suppliers

7,8,9,10-TETRAHYDRO-6H-INDOLO[2,3-B]QUINOXALINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2C(C1)C3=NC4=CC=CC=C4N=C3N2

Technology Process of 6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline

There total 2 articles about 6a,7,8,9,10,10a-Hexahydro-6H-indolo[2,3-b]quinoxaline 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: 58.0%

quinoxalin-2-ylamine (5424-05-5) + cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 7,8,9,10-Tetrahydro-6H-indolo<2,3-b>chinoxalin (96793-51-0)

Guidance literature:

With acetic acid; for 5h; Heating;

DOI:10.1081/SCC-200025595

Reference yield:

→ 7,8,9,10-Tetrahydro-6H-indolo<2,3-b>chinoxalin (96793-51-0)

Guidance literature:

4,5,6,7-Tetrahydro-isatin, 2-Phenylendiamin, sd. Eg.;

DOI:10.1039/jr9640000991

upstream raw materials:

quinoxalin-2-ylamine

cyclohexanone