Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)-

Base Information

• Chemical Name: Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)-
• CAS No.: 1535-92-8
• Molecular Formula: C12H F10 N
• Molecular Weight: 349.131
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID80165343
• Nikkaji Number: J130.382A
• Wikidata: Q83034494
• Mol file: 1535-92-8.mol

Synonyms:1535-92-8;Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)-;bis(pentafluorophenyl)amine;2,3,4,5,6-Pentafluoro-N-(2,3,4,5,6-pentafluorophenyl)aniline;SCHEMBL396117;DTXSID80165343;2,2',3,3',4,4',5,5',6,6'-decafluorodiphenylamine;2,3,4,5,6-Pentafluoro-N-(2,3,4,5,6-pentafluorophenyl)aniline #

Chemical Property of Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)-

Chemical Property:

• Vapor Pressure: 5.62mmHg at 25°C
• Boiling Point: 142.3°Cat760mmHg
• Flash Point: 39.9°C
• PSA: 12.03000
• Density: 1.767g/cm³
• LogP: 4.89420
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 2
• Exact Mass: 348.99493066
• Heavy Atom Count: 23
• Complexity: 345

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)NC2=C(C(=C(C(=C2F)F)F)F)F

Technology Process of Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)-

There total 6 articles about Benzenamine, 2,3,4,5,6-pentafluoro-N-(pentafluorophenyl)- 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: 87.8%

Hexafluorobenzene (392-56-3) → 2,2',3,3',4,4',5,5',6,6'-decafluorodiphenylamine (1535-92-8)

Guidance literature:

With lithium amide; In tetrahydrofuran; at 0 - 80 ℃; for 9.5h; Inert atmosphere; Schlenk technique; Glovebox;

DOI:10.1002/anie.202002768

Reference yield: 27.2%

Hexafluorobenzene (392-56-3) + 2,3,4,5,6-pentafluoroformanilide (58751-08-9) → N-formyl-N,N'-decafluorodiphenyl-tetrafluoro-1,4-phenylene-diamine (945041-53-2) + N,N'-decafluorodiphenyl-tetrafluoro-1,4-phenylenediamine (945041-51-0) + N-formyl-4,4'-bis[(pentafluorophenyl)amino]-2,2',3,3',5,5',6,6'-octafluorodiphenylamine (945041-54-3) + 2,2',3,3',4,4',5,5',6,6'-decafluorodiphenylamine (1535-92-8)

Guidance literature:

2,3,4,5,6-pentafluoroformanilide; With sodium hydride; In tetrahydrofuran; at 20 ℃;

Hexafluorobenzene; With N,N-dimethyl-formamide; In tetrahydrofuran; for 3.5h; Heating;

With hydrogenchloride; In tetrahydrofuran; Further stages. Further byproducts.;

DOI:10.1016/j.jfluchem.2006.06.019

Reference yield:

Hexafluorobenzene (392-56-3) → 2,3,4,5,6-pentafluoroaniline (771-60-8) + 2,2',3,3',4,4',5,5',6,6'-decafluorodiphenylamine (1535-92-8)

Guidance literature:

With ammonia; sodium amide; at -70 ℃; unter Druck;

DOI:10.1038/sj.tpj.6500036

upstream raw materials:

Hexafluorobenzene

ammonia

2,3,4,5,6-pentafluoroformanilide

Downstream raw materials:

N-Methyldecafluorodiphenylamin

4-Nitrophenylacetonitrile

[(C₆F₅)2N]AlH₂*NEtMe₂

[(C₆F₅)2N]2AlH*NEtMe₂