[2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate

Base Information

Chemical Name:[2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate
CAS No.:115178-80-8
Molecular Formula:C₁₂H₁₃NO₄
Molecular Weight:235.24
Hs Code.:
DSSTox Substance ID:DTXSID40872182
Nikkaji Number:J1.560.622C

Synonyms:115178-80-8;DTXSID40872182;2-[Acetyl(methyl)amino]-2-oxoethyl benzoate

Suppliers and Price of [2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of [2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate

Chemical Property:

XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:235.08445790
Heavy Atom Count:17
Complexity:308

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of [2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate

There total 5 articles about [2-[Acetyl(methyl)amino]-2-oxoethyl] benzoate 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: 72.0%

: 108-24-7
acetic anhydride

: 106231-50-9
2-(benzoyloxy)-N-methylacetamide

: 115178-80-8
2-(benzoyloxy)-(N-methyl-N-acetyl)acetamide

Guidance literature:: With sulfuric acid; at 120 ℃; for 1h;
DOI:10.1002/jps.2600770402

Reference yield:

: 532-32-1
sodium benzoate

: 115178-80-8
2-(benzoyloxy)-(N-methyl-N-acetyl)acetamide

Guidance literature:: Multi-step reaction with 5 steps

1: 90 percent / NaI / H₂O / 6 h / 90 °C

2: 80 percent / aq. HCl / 0.17 h / 75 °C

3: 88 percent / SOCl₂ / 3 h / Heating

4: aq. NaOH / benzene / Ambient temperature

5: 72 percent / conc. H₂SO₄ / 1 h / 120 °C

With hydrogenchloride; sodium hydroxide; thionyl chloride; sulfuric acid; sodium iodide; In water; benzene;
DOI:10.1002/jps.2600770402

Reference yield:

: 64649-43-0
(aminocarbonyl)methyl benzoate

: 115178-80-8
2-(benzoyloxy)-(N-methyl-N-acetyl)acetamide

Guidance literature:: Multi-step reaction with 4 steps

1: 80 percent / aq. HCl / 0.17 h / 75 °C

2: 88 percent / SOCl₂ / 3 h / Heating

3: aq. NaOH / benzene / Ambient temperature

4: 72 percent / conc. H₂SO₄ / 1 h / 120 °C

With hydrogenchloride; sodium hydroxide; thionyl chloride; sulfuric acid; In benzene;
DOI:10.1002/jps.2600770402