Propionamide, 3-anilino-N,N-diethyl-

Base Information

• Chemical Name: Propionamide, 3-anilino-N,N-diethyl-
• CAS No.: 91904-57-3
• Molecular Formula: C13H20N2O
• Molecular Weight: 220.315
• DSSTox Substance ID: DTXSID30238758
• Nikkaji Number: J87.400K
• Wikidata: Q83121060
• Mol file: 91904-57-3.mol

Synonyms:Propionamide, 3-anilino-N,N-diethyl-;FC 27;3-Anilino-N,N-diethylpropionamide;BRN 3135085;4-12-00-00889 (Beilstein Handbook Reference);91904-57-3;SCHEMBL11676642;DTXSID30238758;FC-27;LS-124024

Chemical Property of Propionamide, 3-anilino-N,N-diethyl-

Chemical Property:

• Vapor Pressure: 5.87E-06mmHg at 25°C
• Boiling Point: 379.4°Cat760mmHg
• Flash Point: 183.3°C
• Density: 1.037g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 220.157563266
• Heavy Atom Count: 16
• Complexity: 196

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C(=O)CCNC1=CC=CC=C1

Technology Process of Propionamide, 3-anilino-N,N-diethyl-

There total 7 articles about Propionamide, 3-anilino-N,N-diethyl- 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: 83.0%

N,N-diethylacrylamide (2675-94-7,29933-92-4) + aniline (62-53-3) → N,N-diethyl-3-phenylaminopropionamide (91904-57-3)

Guidance literature:

With Imidazole hydrochloride; In neat (no solvent); at 120 ℃; for 5h; Green chemistry;

DOI:10.3390/molecules24234224

Reference yield: 83.0%

→ N,N-diethyl-3-phenylaminopropionamide (91904-57-3)

Guidance literature:

With Imidazole hydrochloride; at 120 ℃; for 5h;

Reference yield:

N,N-dimethyl-3-phenylaminopropionamide (1950-44-3) → N,N-diethyl-3-phenylaminopropionamide (91904-57-3)

Guidance literature:

Multi-step reaction with 2 steps

1: Imidazole hydrochloride / neat (no solvent) / 6 h / 150 °C / Schlenk technique

2: Imidazole hydrochloride / neat (no solvent) / 5 h / 120 °C / Green chemistry

With Imidazole hydrochloride; In neat (no solvent); 2: |Michael Addition;

DOI:10.3390/molecules24234224

upstream raw materials:

3-chloro-N,N-diethylpropanamide

aniline

3-bromo-N,N-diethylpropionylamide

N,N-diethylacrylamide

Downstream raw materials:

N-ethoxycarbonyl-N-phenyl-β-alanine diethylamide

Refernces

• 1、 -. "Method for catalyzing amino protection by imidazole hydrochloride". Paragraph 0039-0043. . Retrieved 2019/08/01.