Tetrabutylammonium bis-trifluoromethanesulfonimidate

Base Information

• Chemical Name: Tetrabutylammonium bis-trifluoromethanesulfonimidate
• CAS No.: 210230-40-3
• Molecular Formula: C18H36F6N2O4S2
• Molecular Weight: 522.617
• Hs Code.: 2935909099
• European Community (EC) Number: 627-915-3
• ChEMBL ID: CHEMBL552483
• DSSTox Substance ID: DTXSID40584990
• NSC Number: 747120
• Mol file: 210230-40-3.mol

Synonyms:210230-40-3;Tetrabutylammonium bis-trifluoromethanesulfonimidate;Tetrabutylammonium bis((trifluoromethyl)sulfonyl)amide;TETRABUTYLAMMONIUM BIS-TRIFLUOROMETHANE&;Bis(trifluoromethylsulfonyl)azanide;tetrabutylazanium;NSC-747120;N,N,N-Tributyl-1-Butanaminium Bis[(Trifluoromethyl)Sulfonyl]Azanide;CHEMBL552483;DTXSID40584990;NSC747120;AKOS015913498;Fetrabutylammonium bis-trifluoromethane&;G70391;Tetrabutylammonium bis(trifluoromethylsulfonyl)imide;tetrabutylammonium bis(trifluoromethanesulfonyl)imide;Tetrabutylammoniumbis((trifluoromethyl)sulfonyl)amide;Tetra-n-butylammonium bis(trifluoromethylsulfonyl)imide;N,N,N-Tributylbutan-1-aminium bis(trifluoromethanesulfonyl)azanide

Chemical Property of Tetrabutylammonium bis-trifluoromethanesulfonimidate

Chemical Property:

• Melting Point: 94-96 °C
• PSA: 85.04000
• LogP: 8.22450
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 14
• Exact Mass: 522.20206895
• Heavy Atom Count: 32
• Complexity: 490

Purity/Quality:

99% ^*data from raw suppliers

Tetrabutylammonium bis-trifluoromethanesulfonimidate for electronic purposes, ≥99.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[N+](CCCC)(CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

Technology Process of Tetrabutylammonium bis-trifluoromethanesulfonimidate

There total 5 articles about Tetrabutylammonium bis-trifluoromethanesulfonimidate 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: 79.0%

tetrabutylammomium bromide (1643-19-2) + potassium bis(trifluoromethylsulfonyl)imide (90076-67-8) → tetrabutylammonium bis[(trifluoromethane)sulfonyl]imide (210230-40-3)

Guidance literature:

In water; at 22 ℃; for 3h;

DOI:10.1021/jacs.1c02235

Reference yield: 73.0%

N-benzyl-bis(trifluoromethanesulfonimide) (35034-08-3) + tetrabutylammomium bromide (1643-19-2) → tetrabutylammonium bis[(trifluoromethane)sulfonyl]imide (210230-40-3)

Guidance literature:

In dichloromethane; at 20 ℃; Inert atmosphere;

DOI:10.1016/j.tet.2009.04.068

Reference yield: 33.0%

tetrabutylammomium bromide (1643-19-2) + bis(trifluoromethane)sulfonimide lithium (90076-65-6) → tetrabutylammonium bis[(trifluoromethane)sulfonyl]imide (210230-40-3)

Guidance literature:

In isopropyl alcohol; at 20 ℃;

DOI:10.1021/acs.joc.0c00114

upstream raw materials:

N-benzyl-bis(trifluoromethanesulfonimide)

tetrabutylammomium bromide

calcium(II) bis(trifluoromethanesulfonyl)imide

tert-butylammonium hexafluorophosphate(V)

Refernces

• 1、 Desnoyer, Addison N.,Nicolay, Amélie,Ziegler, Micah S.,Lakshmi,Cundari, Thomas R.,Tilley, T. Don. "A Dicopper Nitrenoid by Oxidation of a CuICuICore: Synthesis, Electronic Structure, and Reactivity". supporting information. p. 7135 - 7143. Retrieved 2021/05/31.
• 2、 Haubenreisser, Stefan,Niggemann, Meike. "Calcium-catalyzed direct amination of π-activated alcohols". body text. p. 469 - 474. Retrieved 2011/04/16.