3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Base Information

Chemical Name:3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide
CAS No.:884600-93-5
Molecular Formula:C15H11F3INO
Molecular Weight:405.158
Hs Code.:
DSSTox Substance ID:DTXSID50589390
Wikidata:Q82482734

Synonyms:3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide;884600-93-5;3-iodo-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide;Benzamide, 3-iodo-4-methyl-N-[3-(trifluoromethyl)phenyl]-;SCHEMBL2975743;DTXSID50589390;AKOS003526901;DB-294369;A1-31777

Suppliers and Price of 3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:404.98375
Heavy Atom Count:21
Complexity:374

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)I

Technology Process of 3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

There total 3 articles about 3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)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: 92.0%

: 82998-57-0
3-iodo-4-toluic acid

: 98-16-8
3-trifluoromethylaniline

: 884600-93-5
3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Guidance literature:: 3-iodo-4-toluic acid; With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; at 0 - 20 ℃; for 1.16667h;

3-trifluoromethylaniline; With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 1h;

Reference yield: 84.0%

: 52107-98-9
3-iodo-4-methylbenzoyl chloride

: 98-16-8
3-trifluoromethylaniline

: 884600-93-5
3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Guidance literature:: With triethylamine; In dichloromethane; at 20 ℃; for 20h;
DOI:10.1021/jm7010996

Reference yield:

: 82998-57-0
3-iodo-4-toluic acid

: 884600-93-5
3-iodo-4-methyl-N-(3-(trifluoromethyl)phenyl)benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: SOCl₂ / 2 h / Heating

2: iPr₂NEt / CH₂Cl₂ / 3 h / 20 °C

With thionyl chloride; N-ethyl-N,N-diisopropylamine; In dichloromethane;
DOI:10.1021/jm061112p