N-(3-bromophenyl)-2-phenylacetamide

Base Information

• Chemical Name: N-(3-bromophenyl)-2-phenylacetamide
• CAS No.: 13140-73-3
• Molecular Formula: C14H12BrNO
• Molecular Weight: 290.159
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID40351806
• Nikkaji Number: J418.110G
• Wikidata: Q82128540
• Mol file: 13140-73-3.mol

Synonyms:N-(3-bromophenyl)-2-phenylacetamide;13140-73-3;N-(3-BROMO-PHENYL)-2-PHENYL-ACETAMIDE;Cambridge id 5554743;SCHEMBL3463081;DTXSID40351806;JOFHAUBXFFVEOH-UHFFFAOYSA-N;STK012109;AKOS000186333;CS-0321044;AO-548/11154074;SR-01000212932;A1-05229;SR-01000212932-1;Z27789009

Chemical Property of N-(3-bromophenyl)-2-phenylacetamide

Chemical Property:

• PSA: 32.59000
• LogP: 4.27980
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 289.01023
• Heavy Atom Count: 17
• Complexity: 251

Purity/Quality:

99% ^*data from raw suppliers

N-(3-Bromophenyl)-2-phenylacetamide 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(3-bromophenyl)-2-phenylacetamide

There total 5 articles about N-(3-bromophenyl)-2-phenylacetamide 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%

tert-butyl N-(3-bromophenyl)-N-(phenylethynyl)carbamate → N-(3-bromophenyl)-2-phenylacetamide (13140-73-3)

Guidance literature:

With water; trifluoroacetic acid; In dichloromethane; at 20 ℃; for 3h; Time;

DOI:10.1016/j.tetlet.2016.03.052

Reference yield: 66.0%

N-(3-bromophenyl)formamide (37831-25-7) + toluene (108-88-3,15644-74-3,16713-13-6) → N-(3-bromophenyl)-2-phenylacetamide (13140-73-3)

Guidance literature:

With bis(acetylacetonate)nickel(II); di-tert-butyl peroxide; carbon monoxide; at 110 ℃; for 16h; under 15001.5 Torr; Autoclave;

DOI:10.1016/j.tet.2018.05.045

Reference yield: 40.0%

m-Bromoaniline (591-19-5) + (isopropylideneamino) 2-phenylacetate → N-(3-bromophenyl)-2-phenylacetamide (13140-73-3)

Guidance literature:

With CAL-B; In tert-butyl methyl ether; at 55 ℃; for 8h; chemoselective reaction; Green chemistry; Enzymatic reaction;

DOI:10.1039/c3ra46499g

upstream raw materials:

m-Bromoaniline

phenylacetyl chloride

t-butyl<3-(trifluoromethyl)phenyl>-carbamate

1-Bromo-2-phenylacetylene

Downstream raw materials:

2-(3-2-phenylacetamidophenylamino)benzamide