3-Acetyl-2,4,6-trimethylpyridine

Base Information

• Chemical Name: 3-Acetyl-2,4,6-trimethylpyridine
• CAS No.: 56704-25-7
• Molecular Formula: C10H13NO
• Molecular Weight: 163.219
• European Community (EC) Number: 676-608-0
• NSC Number: 108230
• DSSTox Substance ID: DTXSID50296193
• Nikkaji Number: J2.239.469J
• Wikidata: Q82036646
• ChEMBL ID: CHEMBL4564269
• Mol file: 56704-25-7.mol

Synonyms:3-Acetyl-2,4,6-trimethylpyridine;56704-25-7;1-(2,4,6-trimethylpyridin-3-yl)ethanone;1-(2,4,6-trimethylpyridin-3-yl)ethan-1-one;3-acetyl-collidine;NSC108230;SCHEMBL2381068;CHEMBL4564269;DTXSID50296193;RKNKTACHKMTWTD-UHFFFAOYSA-N;MFCD00085730;AKOS009104412;NSC-108230;1-(2,4,6-trimethyl-3-pyridyl)ethanone;AS-64328;FT-0656494;EN300-26004;A831150;J-502900;Z220358230

Chemical Property of 3-Acetyl-2,4,6-trimethylpyridine

Chemical Property:

• Vapor Pressure: 0.0103mmHg at 25°C
• Refractive Index: 1.511
• Boiling Point: 263.4 °C at 760 mmHg
• Flash Point: 120.1 °C
• PSA: 29.96000
• Density: 1.001g/cm³
• LogP: 2.20940
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 163.099714038
• Heavy Atom Count: 12
• Complexity: 179

Purity/Quality:

99% ^*data from raw suppliers

1-(2,4,6-Trimethylpyridin-3-yl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NC(=C1C(=O)C)C)C

Technology Process of 3-Acetyl-2,4,6-trimethylpyridine

There total 6 articles about 3-Acetyl-2,4,6-trimethylpyridine 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: 20.0%

4-(methylamino)-3-penten-2-one (14092-14-9) → 1-(2,4,6-trimethylpyridin-3-yl)ethan-1-one (56704-25-7) + 2-(N-methyl)amino-4,6-dimethylacetophenone (75886-44-1)

Guidance literature:

With chloro-trimethyl-silane; In benzene; at 145 ℃; for 36h; high pressure;

Reference yield: 8.0%

4-(ethylamino)penten-2-one (50967-59-4) → 1-(2,4,6-trimethylpyridin-3-yl)ethan-1-one (56704-25-7) + 2-Acetyl-3,5-dimethyl-N-ethylanilin (63113-24-6)

Guidance literature:

With chloro-trimethyl-silane; In benzene; at 125 ℃; for 36h; high pressure;

Reference yield: 1.0%

4-(n-propylamino)pent-3-en-2-one (51919-01-8) → 1-(2,4,6-trimethylpyridin-3-yl)ethan-1-one (56704-25-7) + 2-(N-propyl)amino-4,6-dimethylacetophenone (75886-45-2)

Guidance literature:

With chloro-trimethyl-silane; In benzene; at 125 ℃; for 36h; high pressure;

upstream raw materials:

4-(methylamino)-3-penten-2-one

4-(ethylamino)penten-2-one

4-(n-propylamino)pent-3-en-2-one

4-N-(n-butylamino)-3-penten-2-one