N,3-Diphenylpropanamide

Base Information

• Chemical Name: N,3-Diphenylpropanamide
• CAS No.: 3271-81-6
• Molecular Formula: C15H15 N O
• Molecular Weight: 225.29
• NSC Number: 100690
• DSSTox Substance ID: DTXSID80295230
• Nikkaji Number: J1.149.256H
• Wikidata: Q82035035
• ChEMBL ID: CHEMBL1480781
• Mol file: 3271-81-6.mol

Synonyms:N,3-Diphenylpropanamide;Hydrocinnamanilide;3271-81-6;NSC 100690;2-benzylacetanilide;NSC100690;3-phenyl-propionamiide;N,3-diphenyl-propionamide;N,3-Diphenylpropanamide #;N~1~,3-diphenylpropanamide;NCIOpen2_006765;MLS000688069;SCHEMBL3061430;CHEMBL1480781;DTXSID80295230;HMS1680I03;HMS2595J21;HMS3380B22;STK414271;AKOS000629809;NSC-100690;SMR000284251;AB00580478-06;SR-01000361693;SR-01000361693-1

Chemical Property of N,3-Diphenylpropanamide

Chemical Property:

• Vapor Pressure: 9.83E-08mmHg at 25°C
• Boiling Point: 434°C at 760 mmHg
• Flash Point: 261.4°C
• Density: 1.128g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 225.115364102
• Heavy Atom Count: 17
• Complexity: 227

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2

Technology Process of N,3-Diphenylpropanamide

There total 106 articles about N,3-Diphenylpropanamide 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: 99.0%

cinnamanilide (3056-73-3,25775-89-7,52393-67-6) → hydrocinnamanilide (3271-81-6)

Guidance literature:

With hydrogen; In methanol; at 20 ℃; for 5h; chemoselective reaction;

DOI:10.1002/aoc.4767

Reference yield: 98.0%

Acetanilid (103-84-4) + benzyl alcohol (100-51-6,185532-71-2) → hydrocinnamanilide (3271-81-6)

Guidance literature:

With tri-tert-butyl phosphine; potassium tert-butylate; nickel diacetate; In 1,4-dioxane; at 80 ℃; for 12h;

Reference yield: 98.0%

aniline (62-53-3) + 3-Phenylpropionic acid (501-52-0) → hydrocinnamanilide (3271-81-6)

Guidance literature:

With dmap; In dichloromethane; at 0 ℃; for 1h;

DOI:10.1246/cl.2007.658

upstream raw materials:

cinnamanilide

An-mPhe-OH

phenethylmagnesium chloride

phenyl isocyanate

Downstream raw materials:

3,N,N'-triphenyl-propionamidine

N-Phenyl-N-nitroso-<3-phenyl-propionamid>

3-Phenyl-1-propanol

Refernces

• 1、 Liu, Jie,Fujita, Hikaru,Kitamura, Masanori,Shimada, Daichi,Kunishima, Munetaka. "Development of a triazinedione-based dehydrative condensing reagent containing 4-(dimethylamino)pyridine as an acyl transfer catalyst". supporting information. p. 4712 - 4719. Retrieved 2021/06/11.
• 2、 Chen, Changpeng,Ling, Liang,Luo, Meiming,Zeng, Xiaoming. "Chromium-catalyzed ligand-free amidation of esters with anilines". supporting information. p. 762 - 766. Retrieved 2021/04/14.