3-(TRIFLUOROMETHOXY)BENZAMIDE

Base Information

• Chemical Name: 3-(TRIFLUOROMETHOXY)BENZAMIDE
• CAS No.: 658-91-3
• Molecular Formula: C8H6F3NO2
• Molecular Weight: 205.136
• Hs Code.: 2924299090
• Mol file: 658-91-3.mol

Synonyms:m-Anisamide,a,a,a-trifluoro- (6CI,8CI);3-Trifluoromethoxybenzamide;

Chemical Property of 3-(TRIFLUOROMETHOXY)BENZAMIDE

Chemical Property:

• Vapor Pressure: 0.0548mmHg at 25°C
• Melting Point: 115-117 °C
• Refractive Index: 1.481
• Boiling Point: 233.8 °C at 760 mmHg
• PKA: 15.39±0.50(Predicted)
• Flash Point: 95.2 °C
• PSA: 52.32000
• Density: 1.381 g/cm³
• LogP: 2.38440

Purity/Quality:

99%, ^*data from raw suppliers

3-(Trifluoromethoxy)benzamide 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 3-(Trifluoromethoxy)benzamide (CAS# 658-91-3) can be used for treatment of protozoal infections, as well as, c-Kit- and c-Fms- mediated diseases. It can also be used for antibacterial properties as it inhibitsthe bacterial cell division protein FtsZ.

Technology Process of 3-(TRIFLUOROMETHOXY)BENZAMIDE

There total 5 articles about 3-(TRIFLUOROMETHOXY)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:

3-methyl-4-nitro-1-(trifluoromethoxy)-6-(trifluoromethyl)-1H-benzo[d][1,2,3]triazol-3-ium trifluoromethanesulfonate + benzamide (55-21-0,27208-38-4) → 2-(trifluoromethoxy)benzamide (127979-74-2) + 3-(trifluoromethoxy)benzamide (658-91-3) + 4-trifluoromethoxybenzamide (456-71-3)

Guidance literature:

With tris(2,2-bipyridine)ruthenium(II) hexafluorophosphate; In acetonitrile; at 20 ℃; for 1h; Overall yield = 42 percentSpectr.; Inert atmosphere; Flow reactor; Irradiation;

DOI:10.3762/bjoc.16.111

Reference yield:

3-(trifluoromethoxy)benzoyl chloride (86270-03-3) → 3-(trifluoromethoxy)benzamide (658-91-3)

Guidance literature:

With ammonia; In tetrahydrofuran; water;

DOI:10.1016/j.bmcl.2008.11.021

Reference yield:

4-cyano-1- (trifluoromethoxy)pyridin-1-ium bis((trifluoromethyl)sulfonyl)amide + benzamide (55-21-0,27208-38-4) → 2-(trifluoromethoxy)benzamide (127979-74-2) + 3-(trifluoromethoxy)benzamide (658-91-3) + 4-trifluoromethoxybenzamide (456-71-3)

Guidance literature:

With tris(2,2-bipyridine)ruthenium(II) hexafluorophosphate; In acetonitrile; at 20 ℃; for 1h; Overall yield = 36 %Spectr.; Sealed tube; Inert atmosphere; Irradiation;

DOI:10.1002/anie.201806296

upstream raw materials:

3-(trifluoromethoxy)benzoyl chloride

benzamide

bis(trifluoromethyl)peroxide

Refernces

• 1、 Cendón, Borja,Gulías, Moisés,Ho, Michelle,No?l, Timothy,Nyuchev, Alexander V.,Sambiagio, Carlo,Struijs, Job J. C.,Wan, Ting,Wang, Ying. "Photocatalytic trifluoromethoxylation of arenes and heteroarenes in continuous-flow". supporting information. p. 1305 - 1312. Retrieved 2020/07/10.
• 2、 Czaplewski, Lloyd G.,Collins, Ian,Boyd, E. Andrew,Brown, David,East, Stephen P.,Gardiner, Mihaly,Fletcher, Rowena,Haydon, David J.,Henstock, Vincent,Ingram, Peter,Jones, Clare,Noula, Caterina,Kennison, Leanne,Rockley, Chris,Rose, Valerie,Thomaides-Brears, Helena B.,Ure, Rebecca,Whittaker, Mark,Stokes, Neil R.. "Antibacterial alkoxybenzamide inhibitors of the essential bacterial cell division protein FtsZ". scheme or table. p. 524 - 527. Retrieved 2011/02/28.