Benzyltributylammonium bromide

Base Information

• Chemical Name: Benzyltributylammonium bromide
• CAS No.: 25316-59-0
• Molecular Formula: C19H34N^.Br
• Molecular Weight: 356.39
• Hs Code.: 29239000
• European Community (EC) Number: 246-819-9
• NSC Number: 152464
• DSSTox Substance ID: DTXSID80948158
• Mol file: 25316-59-0.mol

Synonyms:benzyltributylammonium;benzyltributylammonium bromide;benzyltributylammonium chloride;benzyltributylammonium hydroxide

Chemical Property of Benzyltributylammonium bromide

Chemical Property:

• Appearance/Colour: white to light yellow crystal powder
• Melting Point: 169-171 °C
• Refractive Index: 1.5260 (estimate)
• PSA: 0.00000
• Density: 1.1791 (rough estimate)
• LogP: 2.40770
• Storage Temp.: Inert atmosphere,Room Temperature
• Sensitive.: Hygroscopic
• Water Solubility.: Soluble in water.
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 355.18746
• Heavy Atom Count: 21
• Complexity: 196

Purity/Quality:

99% ^*data from raw suppliers

Benzyltributylammonium Bromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-20/21/22-22
• Safety Statements: 22-24/25-37/39-26-36-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Br-]
• Uses: Benzyltributylammonium bromide can be used:As a phase transfer catalyst in the isomerization reactions of cis-4-formyl-2-azetidinones.As a hydrogen-bond?acceptor in the preparation of deep eutectic solvents, which are used in the isolation of lysozyme from the chicken egg white.In the phase transfer glycosylation of?novobiocin to yield glucosyl-novobiocin.

Technology Process of Benzyltributylammonium bromide

There total 3 articles about Benzyltributylammonium 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:

dibenzyl ether (103-50-4) → benzyl tri-n-butylammonium bromide (25316-59-0)

Guidance literature:

Multi-step reaction with 2 steps

1: benzyltributylammonium bromide / toluene / 34.9 °C

2: 50 °C

With benzyl tri-n-butylammonium bromide; In toluene;

DOI:10.1002/(SICI)1097-4601(1996)28:8<615::AID-KIN7>3.0.CO;2-Y

Reference yield:

benzyl chloride (100-44-7) → benzyl tri-n-butylammonium bromide (25316-59-0)

Guidance literature:

Multi-step reaction with 2 steps

1: benzyltributylammonium bromide / toluene / 34.9 °C

2: 50 °C

With benzyl tri-n-butylammonium bromide; In toluene;

DOI:10.1002/(SICI)1097-4601(1996)28:8<615::AID-KIN7>3.0.CO;2-Y

Reference yield:

tributyl-amine (102-82-9) + benzyl bromide (100-39-0) → benzyl tri-n-butylammonium bromide (25316-59-0)

Guidance literature:

DOI:10.1021/ja01153a022

upstream raw materials:

tributyl-amine

benzyl bromide

dibenzyl ether

benzyl chloride

Downstream raw materials:

N,N-di-n-butylbenzylamine

(1E)-1,3-diphenylpropene

2-[(E)-3-phenylprop-2-enyl]-2,3-dihydro-1H-isoindole-1,3-dione

(E)-2-(4-phenylbut-3-en-1-yl)isoindoline-1,3-dione