N-Ethylformamide

Base Information

• Chemical Name: N-Ethylformamide
• CAS No.: 627-45-2
• Molecular Formula: C3H7 N O
• Molecular Weight: 73.0947
• Hs Code.: 2924199090
• European Community (EC) Number: 211-001-2
• NSC Number: 404522
• UNII: VJF7XCH5B6
• DSSTox Substance ID: DTXSID6060842
• Nikkaji Number: J60.740A
• Wikidata: Q81989204
• ChEMBL ID: CHEMBL9421
• Mol file: 627-45-2.mol

Synonyms:N-ethylformamide

Chemical Property of N-Ethylformamide

Chemical Property:

• Vapor Pressure: 0.689mmHg at 25°C
• Melting Point: -60.43°C (estimate)
• Refractive Index: n20/D 1.432
• Boiling Point: 202-204 °C
• PKA: 16.49±0.23(Predicted)
• Flash Point: 67°C
• PSA: 29.10000
• Density: 0.950 g/mL at 20 °C(lit.)
• LogP: 0.77910
• Storage Temp.: 2-8°C
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 73.052763847
• Heavy Atom Count: 5
• Complexity: 28.1

Purity/Quality:

99%min ^*data from raw suppliers

N-Formylethylamine >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCNC=O

Technology Process of N-Ethylformamide

There total 26 articles about N-Ethylformamide 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%

formic acid (64-18-6) + Nitroethane (79-24-3) → N-formylethylamine (627-45-2)

Guidance literature:

With gold nano particles supported on rutile TiO₂; In toluene; at 70 ℃; for 8h; under 750.075 Torr; chemoselective reaction; Inert atmosphere;

DOI:10.1002/cssc.201500869

Reference yield: 96.0%

ethylamine (75-04-7,85404-22-4) + formic acid ethyl ester (109-94-4) → N-formylethylamine (627-45-2)

Guidance literature:

for 2h; Ambient temperature;

DOI:10.1021/jm00156a024

Reference yield: 90.0%

formic acid (64-18-6) + ethylamine (75-04-7,85404-22-4) → N-formylethylamine (627-45-2)

Guidance literature:

With nano-sulfated titania; In neat liquid; at 20 ℃; for 0.5h; Green chemistry;

DOI:10.1016/j.crci.2012.09.014

upstream raw materials:

ethyl isocyanide

formyl fluoride

ethylamine

Methyl formate

Downstream raw materials:

N-ethyl-cyclohexanamine

N,N-dicyclohexyl-N-ethylamine

N-ethylamphetamine

N,N'-diethylurea

Refernces

• 1、 Amato,Longo,Mazzaccaro,Gervasi. "Microsomal oxidation of N,N-diethylformamide and its effect on P450- dependent monooxygenases in rat liver". . p. 882 - 890. Retrieved 1996.
• 2、 Claes, Laurens,Janssen, Michiel,De Vos, Dirk E.. "Organocatalytic Decarboxylation of Amino Acids as a Route to Bio-based Amines and Amides". . p. 4297 - 4306. Retrieved 2019/08/26.
• 3、 -. "Method for preparing methallyl alcohol and amide simultaneously". Paragraph 0030-0031. . Retrieved 2017/11/29.