N,N,N-tributylbutan-1-aminium 2-{2-[3,3-bis(trifluoromethyl)-1lambda~3~,2-benziodoxol-1(3H)-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-olate

Base Information

• Chemical Name: N,N,N-tributylbutan-1-aminium 2-{2-[3,3-bis(trifluoromethyl)-1lambda~3~,2-benziodoxol-1(3H)-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-olate
• CAS No.: 80559-53-1
• Molecular Formula: C34H44F12INO2
• Molecular Weight: 853.604
• Mol file: 80559-53-1.mol

Synonyms:

Chemical Property of N,N,N-tributylbutan-1-aminium 2-{2-[3,3-bis(trifluoromethyl)-1lambda~3~,2-benziodoxol-1(3H)-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-olate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of N,N,N-tributylbutan-1-aminium 2-{2-[3,3-bis(trifluoromethyl)-1lambda~3~,2-benziodoxol-1(3H)-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-olate

There total 2 articles about N,N,N-tributylbutan-1-aminium 2-{2-[3,3-bis(trifluoromethyl)-1lambda~3~,2-benziodoxol-1(3H)-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-olate 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:

tetrabutylammomium bromide (1643-19-2) + lithium 1,1,1,3,3,3-hexafluoro-2-(2-lithiophenyl)-2-propoxide (70091-67-7) + 1-chloro-3,3-bis(trifluoromethyl)-1,3-dihydro-1λ3-benzo[d][1,2]iodaoxole (76215-48-0) → tetrabutylammonium 2-<3,3-bis(trifluoromethyl)-3H-1,2-benziodoxol-1-yl>-α,α-bis(trifluoromethyl)benzenemethanolate (80559-53-1)

Guidance literature:

With hydrogenchloride; potassium hydroxide; N,N,N,N,-tetramethylethylenediamine; Yield given. Multistep reaction;

DOI:10.1021/ja00059a052

Reference yield:

tetra(n-butyl)ammonium hydroxide (2052-49-5) + lithium 1,1,1,3,3,3-hexafluoro-2-(2-lithiophenyl)-2-propoxide (70091-67-7) + 1-chloro-3,3-bis(trifluoromethyl)-1,3-dihydro-1λ3-benzo[d][1,2]iodaoxole (76215-48-0) → tetrabutylammonium 2-<3,3-bis(trifluoromethyl)-3H-1,2-benziodoxol-1-yl>-α,α-bis(trifluoromethyl)benzenemethanolate (80559-53-1)

Guidance literature:

Yield given. Multistep reaction;

DOI:10.1021/ja00367a065

Reference yield:

tetrabutylammonium 2-<3,3-bis(trifluoromethyl)-3H-1,2-benziodoxol-1-yl>-α,α-bis(trifluoromethyl)benzenemethanolate (80559-53-1) → 2-<3,3-bis(trifluoromethyl)-3H-1,2-benziodoxol-1-yl>-α,α-bis(trifluoromethyl)benzenemethanol (147492-24-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 92 percent / Br₂ / CH₂Cl₂

2: 81 percent / acetonitrile / 0.33 h / Heating

With bromine; In dichloromethane; acetonitrile;

DOI:10.1021/ja00059a052

upstream raw materials:

tetrabutylammomium bromide

lithium 1,1,1,3,3,3-hexafluoro-2-(2-lithiophenyl)-2-propoxide

1-chloro-3,3-bis(trifluoromethyl)-1,3-dihydro-1λ³-benzo[d][1,2]iodaoxole

tetra(n-butyl)ammonium hydroxide

Downstream raw materials:

2-<3,3-bis(trifluoromethyl)-3H-1,2-benziodoxol-1-yl>-α,α-bis(trifluoromethyl)benzenemethanol