N-(2-o×o-2-phenyl-ethyl)forMaMide

Base Information

• Chemical Name: N-(2-o×o-2-phenyl-ethyl)forMaMide
• CAS No.: 73286-37-0
• Molecular Formula: C9H9NO2
• Molecular Weight: 163.176
• Hs Code.: 2924297099
• DSSTox Substance ID: DTXSID80504314
• Nikkaji Number: J329.130H
• Wikidata: Q82358724
• Mol file: 73286-37-0.mol

Synonyms:N-phenacylformamide;

Chemical Property of N-(2-o×o-2-phenyl-ethyl)forMaMide

Chemical Property:

• Melting Point: 70-71 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
• Boiling Point: 387.2±25.0 °C(Predicted)
• PKA: 14.58±0.23(Predicted)
• PSA: 49.66000
• Density: 1.136±0.06 g/cm3(Predicted)
• LogP: 1.45560
• Storage Temp.: Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 163.063328530
• Heavy Atom Count: 12
• Complexity: 162

Purity/Quality:

97% ^*data from raw suppliers

N-(2-Oxo-2-phenylethyl)formamide 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(2-o×o-2-phenyl-ethyl)forMaMide

There total 13 articles about N-(2-o×o-2-phenyl-ethyl)forMaMide 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: 96.0%

2-diformylamino-1-phenylethanone (127118-86-9) → N-(2-oxo-2-phenylethyl)formamide (73286-37-0)

Guidance literature:

With potassium hydroxide; In ethanol; for 0.166667h; Ambient temperature;

DOI:10.1055/s-1990-26959

Reference yield: 96.0%

sodium diformamide (18197-26-7) + α-bromoacetophenone (70-11-1) → N-(2-oxo-2-phenylethyl)formamide (73286-37-0)

Guidance literature:

In ethanol; for 2h; Ambient temperature;

DOI:10.1016/S0040-4039(01)93765-7

Reference yield: 90.0%

formic acid (64-18-6) + 3-phenyl-2H-azirine (7654-06-0) → N-(2-oxo-2-phenylethyl)formamide (73286-37-0)

Guidance literature:

In neat (no solvent); at 20 ℃; for 0.166667h; regioselective reaction;

DOI:10.1021/acs.orglett.0c01206

upstream raw materials:

formic acid

2-aminoacetophenone hydrochloride

2-diformylamino-1-phenylethanone

orthoformic acid triethyl ester

Downstream raw materials:

5-phenyloxazole

5-phenylthiazole

N-(2-hydroxy-2-phenylethyl)formamide

N-(1-Benzoyl-pentyl)-formamide