CID 575009

Base Information

• Chemical Name: CID 575009
• CAS No.: 1941-30-6
• Molecular Formula: C12H28NBr
• Molecular Weight: 266.265
• Hs Code.: 2923.90
• Mol file: 1941-30-6.mol

Synonyms:

Chemical Property of CID 575009

Chemical Property:

• Appearance/Colour: white crystals or crystalline powder
• Melting Point: 266-272 °C
• Refractive Index: 1.5260 (estimate)
• PSA: 0.00000
• Density: 1.1949 (rough estimate)
• LogP: 0.44720
• Storage Temp.: Store below +30°C.
• Sensitive.: Hygroscopic
• Solubility.: H2O: 0.1 g/mL, clear
• Water Solubility.: 100 g/L
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 265.14051
• Heavy Atom Count: 14
• Complexity: 85.4

Purity/Quality:

99% ^*data from raw suppliers

Tetrapropylammonium Bromide ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC[N+](CCC)(CCC)CCC.[Br-]
• Uses: Tetra-n-propylammonium bromide, is used as surface-active agents, Solvents, Intermediates, Active Ingredient for Conditioners, Antistatic Agent, Detergent Sanitisers, Softner for textiles and paper products, Phase Transfer Catalyst, Antimicrobials, Disinfection Agents And Sanitizers, Slimicidal Agents, Emulsifying Agents and Pigment Dispersers. Supporting electrolyte

Technology Process of CID 575009

There total 6 articles about CID 575009 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:

Br(1-)*C12H28N(1+)*C4H10O2 → tert.-butylhydroperoxide (75-91-2) + tetra-n-propylammonium bromide (1941-30-6)

Guidance literature:

In [D₃]acetonitrile; at 24.84 ℃; Equilibrium constant;

DOI:10.1007/s00706-014-1234-5

Reference yield:

tri-n-propylamine (102-69-2) + propyl bromide (106-94-5) → tetra-n-propylammonium bromide (1941-30-6)

Guidance literature:

In ethanol;

DOI:10.1002/jps.2600550413

Reference yield:

propyl bromide (106-94-5) → tetra-n-propylammonium bromide (1941-30-6)

Guidance literature:

With tri-n-propylamine; In N-methyl-acetamide;

upstream raw materials:

tri-n-propylamine

propyl bromide

C₆H₅O^(1-)*C₆H₆O*C₁₂H₂₈N⁽¹⁺⁾

benzyl bromide

Downstream raw materials:

tri-n-propylamine

propene

C₁₂H₂₈N⁽¹⁺⁾*C₈H₅BrN₂P^(1-)

C₁₂H₂₈N⁽¹⁺⁾*C₈BrF₅N₂PS₂^(1-)

Refernces

Efficient ligand-free copper-catalyzed N-arylation of amides with aryl halides in water

10.1016/j.tetlet.2011.01.003

The study develops an efficient and environmentally friendly method for the N-arylation of amides using aryl halides, catalyzed by ligand-free copper(I) oxide (Cu2O) in water. This method provides a practical approach to synthesizing N-arylated amides, which are valuable in pharmaceuticals and materials science. The research focuses on optimizing reaction conditions, including the choice of copper catalyst, base, and phase-transfer catalyst, to achieve good to excellent yields of the desired N-arylated products. The method proves effective for a variety of amides and aryl iodides, making it a versatile tool for organic synthesis.