TRIISOBUTYLAMINE

Base Information

• Chemical Name: TRIISOBUTYLAMINE
• CAS No.: 1116-40-1
• Molecular Formula: C12H27 N
• Molecular Weight: 185.353
• Hs Code.: 2921199090
• European Community (EC) Number: 214-236-9
• UN Number: 2734
• UNII: 34282R15S8
• DSSTox Substance ID: DTXSID7026233
• Nikkaji Number: J27.949H
• Wikidata: Q27256318
• Mol file: 1116-40-1.mol

Synonyms:Triisobutylamine(6CI,7CI,8CI)

Chemical Property of TRIISOBUTYLAMINE

Chemical Property:

• Vapor Pressure: 0.538mmHg at 25°C
• Melting Point: -21.8°C
• Refractive Index: n20/D 1.423(lit.)
• Boiling Point: 190.6°Cat760mmHg
• PKA: pK1:10.42(+1) (25°C)
• Flash Point: 57.2°C
• PSA: 3.24000
• Density: 0.788g/cm³
• LogP: 3.25640
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 185.214349865
• Heavy Atom Count: 13
• Complexity: 92.5
• Transport DOT Label: Corrosive Flammable Liquid

Purity/Quality:

98%,99%, ^*data from raw suppliers

Triisobutylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,N,T
• Statements: 36/37/38-51/53-41-38-23/24-22
• Safety Statements: 26-36-61-45-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aliphatic
• Canonical SMILES: CC(C)CN(CC(C)C)CC(C)C
• Uses: Triisobutylamine is suitable to develop second generation ionic liquid matrices for MALDI-MS of peptides, proteins and carbohydrates. It may be used in the separation of cis-fatty acid salts and and trans-fatty acid (elaidic acid) salts using a new organic solvent nanofiltration membrane based on polydicyclopentadiene. It may be used as base in the synthesis of acroyl ammonium derivatives.

Technology Process of TRIISOBUTYLAMINE

There total 15 articles about TRIISOBUTYLAMINE 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: 53.0%

isobutyraldehyde (78-84-2) → triisobutylamine (1116-40-1)

Guidance literature:

With rhodium(III) chloride; carbon monoxide; ammonium carbonate; In methanol; water; at 160 ℃; for 22h; under 38002.6 Torr; Autoclave;

DOI:10.1002/ejoc.201901175

Reference yield: 19.9%

isobutyraldehyde (78-84-2) → diisobutylamine (110-96-3) + Isobutyronitrile (78-82-0) + triisobutylamine (1116-40-1) + N-isobutylideneisobutylamine (6898-82-4) + isobutylamine (78-81-9)

Guidance literature:

With ammonia; hydrogen; palladium on activated charcoal; at 180 ℃; under 760 Torr; Product distribution; Mechanism; other catalyst, temperature;;

Reference yield: 4.0%

Isobutyronitrile (78-82-0) → diisobutylamine (110-96-3) + triisobutylamine (1116-40-1) + isobutylamine (78-81-9)

Guidance literature:

With sodium tetrahydroborate; hydrogen; nickel dichloride; In tert-butyl alcohol; at 70 ℃; for 12h; under 760.051 Torr;

DOI:10.1134/S1070363216020110

upstream raw materials:

Isobutyl bromide

Isobutyl iodide

isobutyraldehyde

isobutylamine

Downstream raw materials:

diisobutylamine hydrochloride

isobutene

borane-ammonia complex

borazine

Refernces

• 1、 Mokhov,Popov,Shcherbakova. "Colloid and nanosized catalysts in organic synthesis: XII. Hydrogenation of carbonitriles catalyzed by nickel nanoparticles". . p. 273 - 280. Retrieved 2016/04/20.
• 2、 Smaeva, T. P.,Yakushkin, M. I.,Dobrotvorskii, A. M.. "REDUCTIVE AMINATION OF ALIPHATIC ALDEHYDES IN THE PRESENCE OF GROUP-VIII METALS". . p. 1221 - 1225. Retrieved 2007/10/02.