Tetrabutylammonium chloride

Base Information

• Chemical Name: Tetrabutylammonium chloride
• CAS No.: 1112-67-0
• Deprecated CAS: 25147-59-5,1095010-41-5,959714-50-2,959714-52-4,1393673-90-9
• Molecular Formula: C16H36ClN
• Molecular Weight: 277.922
• Hs Code.: 2923.90
• European Community (EC) Number: 214-195-7
• UNII: DDT9H3MSD3
• DSSTox Substance ID: DTXSID10883644
• Wikipedia: Tetrabutylammonium_chloride
• Wikidata: Q27123074
• Metabolomics Workbench ID: 58015
• ChEMBL ID: CHEMBL1078612
• Mol file: 1112-67-0.mol

Synonyms:Bu(4)NBr;tetra-n-butylammonium dodecylsulfate;tetra-n-butylammonium hexafluorophosphate;tetrabutylammonium;tetrabutylammonium azide;tetrabutylammonium bromide;tetrabutylammonium chloride;tetrabutylammonium cyanide;tetrabutylammonium fluoride;tetrabutylammonium hydrogen sulfate;tetrabutylammonium hydroxide;tetrabutylammonium iodide;tetrabutylammonium monophosphate;tetrabutylammonium nitrate;tetrabutylammonium perchlorate;tetrabutylammonium sulfate;tetrabutylammonium sulfate (1:1), sodium salt

Chemical Property of Tetrabutylammonium chloride

Chemical Property:

• Appearance/Colour: white crystals, granules or powder
• Melting Point: 83-86 °C
• Refractive Index: 1,421-1,423
• Flash Point: >110°C
• PSA: 0.00000
• Density: 0.98
• LogP: 2.00760
• Storage Temp.: Store under Nitrogen
• Sensitive.: Light Sensitive
• Solubility.: H2O: 20 mg/mL, clear, colorless
• Water Solubility.: SOLUBLE
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 277.2536278
• Heavy Atom Count: 18
• Complexity: 116

Purity/Quality:

80% ^*data from raw suppliers

Tetra- n-butylammonium chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-36/38
• Safety Statements: 26-37/39-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Quaternary Amines
• Canonical SMILES: CCCC[N+](CCCC)(CCCC)CCCC.[Cl-]
• Uses: Substitute in solution for glass-calomel electrode systems, coagulant for silver iodide solutions, stereospecific catalyst. Tetrabutylammonium Chloride is used in the preparation of polypyrrole coatings with self healing properties for iron corrosion.

Technology Process of Tetrabutylammonium chloride

There total 36 articles about Tetrabutylammonium chloride 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: 80.0%

bis(tetra-n-butylammonium) trans-dioxotetracyanoosmate(VI) + tetramethlyammonium chloride (75-57-0) → tetramethyl-ammonium trans-dioxotetracyanoosmate(VI) + tetrabutyl-ammonium chloride (1112-67-0)

Guidance literature:

In ethanol; dichloromethane; soln. of NMe4Cl in EtOH added to a soln. of (n-Bu4N)2(OsO2(CN)4) in CH2Cl2; pptd. Os complex recrystd. from CH3CN;

Reference yield: 70.0%

tetrabutylammonium trans-(18)O-dioxotetracyanoosmate(VI) + tetramethlyammonium chloride (75-57-0) → tetramethyl-ammonium trans-(18)O-dioxotetracyanoosmate(VI) + tetrabutyl-ammonium chloride (1112-67-0)

Guidance literature:

In ethanol; dichloromethane; soln. of Me4NCl in EtOH added to a soln. of (n-Bu4N)2(Os(18)O2(CN)4) in CH2Cl2; pptd. Os complex recrystd. from CH3CN;

Reference yield: 63.0%

{N(C4H9)4}(1+)*{Mo3OCl6(OCOCH3)3}(1-)*CH3COCH3={N(C4H9)4}{Mo3OCl6(OCOCH3)3}*CH3COCH3 + trimethylphosphane (594-09-2) → {Mo3OCl4(OCOCH3)3(P(CH3)3)2} + tetrabutyl-ammonium chloride (1112-67-0)

Guidance literature:

With Zn; In tetrahydrofuran; mixture of Mo-compound, Zn metal dust and trimethylphosphine was stirred at room temp. in THF under Ar for 36 h; filtn., the ppt. was treated with acetone, filtn., the filtrate was layered with hexane, crystn. after several days of standing;

DOI:10.1021/ja00018a030

upstream raw materials:

tetrabutylammonium perchlorate

triethylamine hydrochloride

tetra-n-butylammonium p-nitrophenoxide

tetrabutylammonium 2,4-dinitrophenoxide

Downstream raw materials:

butyl octanoate

tetrabutylammonium benzoate

tetrabutylammonium thiocyanate

tetrabutylammonium perchlorate

Refernces

• 1、 Danilova, O. I.,Esikova, I. A.,Yufit, S. S.. "". . . Retrieved 1988.
• 2、 Cotton, F. Albert,Shang, Maoyu,Sun, Zhong Sheng. "The First Triangular Trinuclear Cluster Compounds of Molybdenum with Nine Cluster Electrons: 1-n, n = 1-3". . p. 6917 - 6922. Retrieved 1991.
• 3、 Mashkovsky, Alexander A.,Nabiullin, Ahat A.,Odinokov, Stanislav E.. "Infrared Spectroscopic Studies of Hydrogen Bonding in Triethylammonium Slats. Part 4. Rearrangement of Hydrogen-bonded Ion Pairs of Triethylammonium Salts caused by Interaction with Tetrabutylammonium Salts in Solution". . p. 1879 - 1884. Retrieved 1987.
• 4、 Toledo, Alberto,Meana, Isabel,Albéniz, Ana C.. "Formal Gold-to-Gold Transmetalation of an Alkynyl Group Mediated by Palladium: A Bisalkynyl Gold Complex as a Ligand to Palladium". supporting information. p. 13216 - 13220. Retrieved 2015/09/15.
• 5、 Molina, Lidia,Moreno-Clavijo, Elena,Moreno-Vargas, Antonio J.,Carmona, Ana T.,Robina, Inmaculada. "Synthesis of a C3-symmetric furyl-cyclopeptide platform with anion recognition properties". experimental part. p. 4049 - 4055. Retrieved 2010/09/10.