N-(2-fluorophenyl)benzamide

Base Information

• Chemical Name: N-(2-fluorophenyl)benzamide
• CAS No.: 367-97-5
• Molecular Formula: C13H10 F N O
• Molecular Weight: 215.227
• NSC Number: 51886
• UNII: AW7N5CVS37
• DSSTox Substance ID: DTXSID30957937
• Nikkaji Number: J503.765D
• Wikidata: Q82938419
• Mol file: 367-97-5.mol

Synonyms:N-(2-fluorophenyl)benzamide;367-97-5;Benzanilide, 2-fluoro-;NSC51886;CBMicro_009304;Cambridge id 5136687;2'-FLUOROBENZANILIDE;AW7N5CVS37;SCHEMBL2113824;Benzamide, N-(2-fluorophenyl)-;CCG-710;DTXSID30957937;UZPGWRCSQTZJAB-UHFFFAOYSA-N;SMSF0003648;NSC-51886;STK018903;AKOS002960471;CB12412;N-Benzoyl derivative of o-fluoroaniline;BIM-0009522.P001;N-(2-Fluorophenyl)benzenecarboximidic acid;AO-548/05797021

Chemical Property of N-(2-fluorophenyl)benzamide

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 215.074642105
• Heavy Atom Count: 16
• Complexity: 238

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2F

Technology Process of N-(2-fluorophenyl)benzamide

There total 15 articles about N-(2-fluorophenyl)benzamide 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: 100.0%

benzoic acid methyl ester (93-58-3,5705-52-2,80226-58-0) + 2-Fluoroaniline (348-54-9) → N-(2-fluorophenyl)benzenamine (367-97-5)

Guidance literature:

2-Fluoroaniline; With trimethylaluminum; In toluene; for 1h; Inert atmosphere;

benzoic acid methyl ester; In toluene; at 20 - 90 ℃;

DOI:10.1021/acs.jmedchem.1c01264

Reference yield: 98.0%

iodobenzene (591-50-4) + 2-Fluoroaniline (348-54-9) + carbon monoxide (201230-82-2) → N-(2-fluorophenyl)benzenamine (367-97-5)

Guidance literature:

iodobenzene; 2-Fluoroaniline; With palladium diacetate; triethylamine; In water; for 0.166667h;

carbon monoxide; In water; at 100 ℃; for 8h; under 10343.2 Torr;

DOI:10.1080/00397911.2010.523155

Reference yield: 96.0%

iodobenzene (591-50-4) + cyclopentadienyl iron(II) dicarbonyl dimer (38117-54-3) + 2-Fluoroaniline (348-54-9) → N-(2-fluorophenyl)benzenamine (367-97-5)

Guidance literature:

With palladium diacetate; 1,8-diazabicyclo[5.4.0]undec-7-ene; tricyclohexylphosphine; In toluene; at 110 ℃; for 12h;

DOI:10.1246/cl.2011.904

upstream raw materials:

iodobenzene

2-Fluoroaniline

carbon monoxide

benzoyl chloride

Downstream raw materials:

N-phenyl-N-2-fluorophenylbenzamide

N-cyclopropyl-N-(2-fluorophenyl)benzamide

4-fluoro-2-phenylbenzo[d]thiazole

2-Phenylbenzothiazole

Refernces

• 1、 Tang, Jing-Jing,Yu, Xiaoqiang,Yamamoto, Yoshinori,Bao, Ming. "Visible-Light-Promoted Iron-Catalyzed N-Arylation of Dioxazolones with Arylboronic Acids". . p. 13955 - 13961. Retrieved 2021/11/20.
• 2、 Viveki, Amol B.,Garad, Dnyaneshwar N.,Gonnade, Rajesh G.,Mhaske, Santosh B.. "Para -Selective copper-catalyzed C(sp2)-H amidation/dimerization of anilides via a radical pathway". supporting information. p. 1565 - 1568. Retrieved 2020/02/13.