2,4,6-Triethylaniline

Base Information

• Chemical Name: 2,4,6-Triethylaniline
• CAS No.: 19779-32-9
• Molecular Formula: C12H19N
• Molecular Weight: 177.29
• DSSTox Substance ID: DTXSID10512629
• Nikkaji Number: J28.428I
• Wikidata: Q82371960
• Mol file: 19779-32-9.mol

Synonyms:2,4,6-Triethylaniline;19779-32-9;Benzenamine, 2,4,6-triethyl-;(2,4,6-triethylphenyl)amine;SCHEMBL112571;DTXSID10512629;CHEMBRDG-BB 5216351;AKOS006280793;AS-79053;CS-0152542;E76294

Chemical Property of 2,4,6-Triethylaniline

Chemical Property:

• Vapor Pressure: 0.006mmHg at 25°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 177.151749610
• Heavy Atom Count: 13
• Complexity: 130

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C(C(=C1)CC)N)CC

Technology Process of 2,4,6-Triethylaniline

There total 5 articles about 2,4,6-Triethylaniline 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: 82.0%

2-nitro-1,3,5-triethylbenzene (13402-30-7) → 2,4,6-triethylbenzenamine (19779-32-9)

Guidance literature:

With hydrogenchloride; tin; water; In ethanol; at 70 ℃; for 2h;

DOI:10.1021/jo101717m

Reference yield: 63.0%

1,3,5-triethylbenzene (102-25-0) → 2,4,6-triethylbenzenamine (19779-32-9)

Guidance literature:

With tert-butyl N-tosyloxycarbamate; at 20 ℃; for 36h; chemoselective reaction;

DOI:10.1002/adsc.202100236

Reference yield:

benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 2,4,6-triethylbenzenamine (19779-32-9)

Guidance literature:

Multi-step reaction with 3 steps

1: AlCl₃

2: 70 percent / nitration (method of Powell and Johnson in "Organic Syntheses"; Wiley: New York, 1955; Collect_. Vol_. 3, p. 449)

3: H₂ / 5percent Pd/C / ethanol

With aluminium trichloride; hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1021/jo00183a024

upstream raw materials:

2-nitro-1,3,5-triethylbenzene

acetic acid

1,3,5-triethylbenzene

benzene

Downstream raw materials:

2,4,6-triethylphenol

2-iodo-1,3,5-triethylbenzene

acetic acid-(2,4,6-triethyl-anilide)

2,4,6-triethyl-benzonitrile