N-Ethylformanilide

Base Information

• Chemical Name: N-Ethylformanilide
• CAS No.: 5461-49-4
• Molecular Formula: C9H11NO
• Molecular Weight: 149.192
• Hs Code.: 2924299090
• NSC Number: 46913,5950
• UNII: NB4QAL8858
• DSSTox Substance ID: DTXSID3063918
• Nikkaji Number: J114.002G
• Wikidata: Q81991096
• Mol file: 5461-49-4.mol

Synonyms:N-Ethylformanilide;Formamide, N-ethyl-N-phenyl-;5461-49-4;Formanilide, N-ethyl-;NSC 5950;NB4QAL8858;NSC-5950;NSC 46913;NSC-46913;AI3-12080;N-ethyl formanilide;Ethyl(phenyl)formamide;Ethyl(phenyl)formamide #;ETHYLPHENYLFORMAMIDE;UNII-NB4QAL8858;SCHEMBL305842;DTXSID3063918;NSC5950;NSC46913;AKOS014312241

Chemical Property of N-Ethylformanilide

Chemical Property:

• Vapor Pressure: 0.0133mmHg at 25°C
• Boiling Point: 259°Cat760mmHg
• Flash Point: 113.8°C
• PSA: 20.31000
• Density: 1.056g/cm³
• LogP: 2.30520
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 149.084063974
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of N-Ethylformanilide

There total 27 articles about N-Ethylformanilide 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: 97.0%

carbon dioxide (124-38-9,18923-20-1) + N-ethyl-N-phenylamine (103-69-5) → N-ethylformanilide (5461-49-4)

Guidance literature:

With phenylsilane; tetrabutylammonium acetate; In neat (no solvent); at 30 ℃; for 12h; under 760.051 Torr; Reagent/catalyst; Schlenk technique;

DOI:10.1039/d0cc01371d

Reference yield: 93.0%

formic acid (64-18-6) + N-ethyl-N-phenylamine (103-69-5) → N-ethylformanilide (5461-49-4)

Guidance literature:

formic acid; With acetic anhydride; at 70 ℃; for 1h; Inert atmosphere;

N-ethyl-N-phenylamine; at 50 ℃; Inert atmosphere;

DOI:10.1021/acs.orglett.0c00432

Reference yield: 90.0%

carbon dioxide (124-38-9,18923-20-1) + N-ethyl-N-phenylamine (103-69-5) → N-ethylformanilide (5461-49-4) + N-methyl-N-ethylaniline (613-97-8)

Guidance literature:

With cyclopentadienyl iron(II) dicarbonyl dimer; tributylphosphine; phenylsilane; In acetonitrile; at 30 ℃; for 24h; under 760.051 Torr; Reagent/catalyst; Schlenk technique; Sealed tube;

DOI:10.1002/adsc.201900906

upstream raw materials:

formanilide; silver (I)-compound

ethyl iodide

formamide

N-ethyl-N-phenylamine

Downstream raw materials:

(E)-2-Nonenal

2.6-dimethyl-3-oxymethyl-heptane

i-Amyl alcohol

ethylamine

Refernces

• 1、 Li, Hu,Li, Zhengyi,Wu, Hongguo,Yang, Song,Yu, Zhaozhuo,Zhang, Lilong,Zhu, Kaixun. "A substituent- And temperature-controllable NHC-derived zwitterionic catalyst enables CO2upgrading for high-efficiency construction of formamides and benzimidazoles". supporting information. p. 5759 - 5765. Retrieved 2021/08/23.
• 2、 Duan, Wentao,Lian, Qi,Wang, Songping,Wei, Wentao,Zhou, Jingwei. "Catalyst-free photoinduced selective oxidative C(sp3)-C(sp3) bond cleavage in arylamines". supporting information. p. 3261 - 3267. Retrieved 2021/05/21.