n,2,4,6-Tetramethylbenzamide

Base Information

• Chemical Name: n,2,4,6-Tetramethylbenzamide
• CAS No.: 72261-78-0
• Molecular Formula: C11H15NO
• Molecular Weight: 177.2429
• NSC Number: 94812
• DSSTox Substance ID: DTXSID10294155
• Nikkaji Number: J484.229D
• Wikidata: Q82033271

Synonyms:n,2,4,6-tetramethylbenzamide;72261-78-0;NSC94812;starbld0047688;NCIOpen2_001314;SCHEMBL354669;DTXSID10294155;2,4,6-trimethyl-N-methylbenzamide;NSC-94812;AKOS009131103

Chemical Property of n,2,4,6-Tetramethylbenzamide

Chemical Property:

• Vapor Pressure: 0.015mmHg at 25°C
• Boiling Point: 256.9°Cat760mmHg
• Flash Point: 147.3°C
• Density: 0.992g/cm³
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 179

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1)C)C(=O)NC)C

Technology Process of n,2,4,6-Tetramethylbenzamide

There total 7 articles about n,2,4,6-Tetramethylbenzamide 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: 65.0%

trifluoromethane sulfonates de N-methyl(trimethyl-2,4,6 phenyl)-2 oxazolinium-1,3 (96841-80-4) → N-methyl trimethyl-2,4,6,benzamide (72261-78-0) + 2,4,6,N-Tetramethyl-N-(3-methyl-pentyl)-benzamide (98258-43-6)

Guidance literature:

With lithium di-sec-butylcuprate; In diethyl ether; at -15 ℃; for 2h;

DOI:10.1016/S0040-4039(00)98499-5

Reference yield: 65.0%

C-mesityl-N-methylnitrone (41106-03-0,53696-93-8,62701-67-1) → N-methyl trimethyl-2,4,6,benzamide (72261-78-0)

Guidance literature:

With trifluoroacetic acid; In acetonitrile; at 92 ℃; for 0.166667h; Inert atmosphere; UV-irradiation;

DOI:10.1002/anie.201300504

Reference yield: 41.8%

mesytaldehyde (487-68-3) + N-Methyl-O-p-nitrophenylsulphonylhydroxylamine (85462-16-4) → N-methyl trimethyl-2,4,6,benzamide (72261-78-0) + 2-(Formyl-methylamino)-1,3,5-trimethylbenzol (5279-62-9)

Guidance literature:

In chloroform-d1; for 6h; Ambient temperature;

DOI:10.1021/jo00042a032

upstream raw materials:

mesytaldehyde

N-Methyl-O-p-nitrophenylsulphonylhydroxylamine

trifluoromethane sulfonates de N-methyl(trimethyl-2,4,6 phenyl)-2 oxazolinium-1,3

Lawessons reagent

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