N-(3-Acetylphenyl)-N-methylacetamide

Base Information

• Chemical Name: N-(3-Acetylphenyl)-N-methylacetamide
• CAS No.: 325715-13-7
• Molecular Formula: C11H13NO2
• Molecular Weight: 191.23
• Hs Code.: 2924297099
• European Community (EC) Number: 608-756-9
• DSSTox Substance ID: DTXSID00457217
• Wikidata: Q82279980
• Mol file: 325715-13-7.mol

Synonyms:N-(3-ACETYLPHENYL)-N-METHYLACETAMIDE;325715-13-7;SCHEMBL2894413;DTXSID00457217;FTTSEBPNAOFITJ-UHFFFAOYSA-N;MFCD08445602;AKOS015998664;PS-4720;CS-0155111;FT-0602019;D81992;A875583

Chemical Property of N-(3-Acetylphenyl)-N-methylacetamide

Chemical Property:

• Vapor Pressure: 0.000163mmHg at 25°C
• Refractive Index: 1.553
• Boiling Point: 330.7 °C at 760 mmHg
• Flash Point: 146.3 °C
• PSA: 37.38000
• Density: 1.108 g/cm³
• LogP: 1.87190
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 237

Purity/Quality:

97% ^*data from raw suppliers

N-(3-Acetylphenyl)-N-methylacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(3-Acetylphenyl)-N-methylacetamide

There total 3 articles about N-(3-Acetylphenyl)-N-methylacetamide 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: 100.0%

3-Acetamidoacetophenone (7463-31-2) + methyl p-toluene sulfonate (80-48-8) → N-(3-acetylphenyl)-N-methylacetamide (325715-13-7)

Guidance literature:

3-Acetamidoacetophenone; With sodium hydroxide; In toluene; at 20 ℃; for 0.5h;

methyl p-toluene sulfonate; In toluene; at 0 - 50 ℃; for 13h;

Reference yield: 98.7%

3-Acetamidoacetophenone (7463-31-2) + dimethyl sulfate (77-78-1) → N-(3-acetylphenyl)-N-methylacetamide (325715-13-7)

Guidance literature:

With sodium hydroxide; In DMF (N,N-dimethyl-formamide); toluene; at 10 - 20 ℃; for 3h;

Reference yield:

1-(3-aminophenyl)ethanone (99-03-6) → N-(3-acetylphenyl)-N-methylacetamide (325715-13-7)

Guidance literature:

Multi-step reaction with 2 steps

1: toluene / 3 h / 20 - 55 °C

2: sodium hydroxide / toluene / 8 h / 60 °C / Inert atmosphere

With sodium hydroxide; In toluene;

upstream raw materials:

3-Acetamidoacetophenone

dimethyl sulfate

methyl p-toluene sulfonate

1-(3-aminophenyl)ethanone

Downstream raw materials:

(E)-4-(3-(N-nethylacetamido)phenyl)-4-oxobut-2-enoic acid

(E)-N-methyl-N-(3-(1-((3-methyl-4H-1,2,4-triazol-4-yl)imino)ethyl)phenyl)acetamide

N-(3-(1-(2-(4-chlorophenoxy)phenylamino)ethyl)phenyl)-N-methylacetamide