Tetrahexylammonium bromide

Base Information

• Chemical Name: Tetrahexylammonium bromide
• CAS No.: 4328-13-6
• Deprecated CAS: 515815-73-3
• Molecular Formula: C24H52BrN
• Molecular Weight: 434.588
• Hs Code.: 29239000
• European Community (EC) Number: 224-363-1
• DSSTox Substance ID: DTXSID50884059
• Mol file: 4328-13-6.mol

Synonyms:tetrahexylammonium;tetrahexylammonium benzoate;tetrahexylammonium bromide;tetrahexylammonium chloride;tetrahexylammonium hydroxide;tetrahexylammonium iodide;tetrahexylammonium perchlorate;tetrahexylammonium sulfate (1:1);tetrahexylammonium thicyanate

Chemical Property of Tetrahexylammonium bromide

Chemical Property:

• Appearance/Colour: white to faintly yellow powder
• Melting Point: 99-100 °C(lit.)
• Refractive Index: 1.5260 (estimate)
• PSA: 0.00000
• Density: 1.0628 (rough estimate)
• LogP: 5.12840
• Storage Temp.: Inert atmosphere,Room Temperature
• Sensitive.: Hygroscopic
• Solubility.: almost transparency in Methanol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 20
• Exact Mass: 433.32831
• Heavy Atom Count: 26
• Complexity: 195

Purity/Quality:

98% ^*data from raw suppliers

Tetra-n-hexylammonium bromide ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

Useful:

• Canonical SMILES: CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]
• Uses: Tetrahexylammonium bromide can be used:As a hydrogen bond acceptor in the preparation of deep eutectic solvents which can be used for desulfurization and denitrogenation from n-heptane.To produce aqueous biphasic system for the heavy metal ions preconcentration.As a phase transfer salt to fabricate an optical chemical gas-sensor.

Technology Process of Tetrahexylammonium bromide

There total 1 articles about Tetrahexylammonium bromide 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:

C6H5O(1-)*C6H6O*C24H52N(1+) (1392488-21-9) + benzyl bromide (100-39-0) → (benzyloxy)benzene (946-80-5) + tetrahexylammonium bromide (4328-13-6) + phenol (108-95-2,27073-41-2)

Guidance literature:

In acetonitrile; at 20 ℃;

DOI:10.1021/ja304808u

Reference yield: 96.0%

propyl methanesulfonate (1912-31-8) + tetrahexylammonium bromide (4328-13-6) → Methanesulfonatetetrahexyl-ammonium; (105140-20-3) + propyl bromide (106-94-5)

Guidance literature:

In benzene; at 80 ℃;

Reference yield: 94.0%

K9[PW9O34]·16H2O + [1,1′-biphenyl]-2-yltrichlorosilane (18030-62-1) + tetrahexylammonium bromide (4328-13-6) → THA3[PW9O34(PhPhSiOH)3]

Guidance literature:

In acetonitrile; at 20 ℃; Inert atmosphere; Schlenk technique;

DOI:10.1039/d1dt00256b

upstream raw materials:

C₆H₅O^(1-)*C₆H₆O*C₂₄H₅₂N⁽¹⁺⁾

benzyl bromide

Downstream raw materials:

Methanesulfonatetetrahexyl-ammonium;

propyl bromide

C₂₄H₅₂N⁽¹⁺⁾*C₆Br₃F₅P^(1-)

C₂₄H₅₂N⁽¹⁺⁾*C₁₂BrClF₁₀P^(1-)

Refernces