N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide

Base Information

• Chemical Name: N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide
• CAS No.: 116332-61-7
• Molecular Formula: C10H10F3NO2
• Molecular Weight: 233.19
• Hs Code.: 2924297099
• European Community (EC) Number: 811-113-7
• DSSTox Substance ID: DTXSID60555389
• Nikkaji Number: J3.195.312J
• Wikidata: Q82436718
• Mol file: 116332-61-7.mol

Synonyms:N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide;116332-61-7;N-Methoxy-N-methyl-4-(trifluoromethyl)-benzenecarboxamide;Benzamide, N-methoxy-N-methyl-4-(trifluoromethyl)-;MFCD08689795;SCHEMBL1852354;DTXSID60555389;AKOS005072906;HA-0808;SY050834;CS-0061700;M2762;N-methoxy-N-methyl-4-trifluoromethylbenzamide;N-Methoxy-N-methyl-4-trifluoromethyl-benzamide;W16955;J-523620;F1903-0145;N-methoxy-N-methyl-4-(trifluoromethyl)benzenecarboxamide

Chemical Property of N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide

Chemical Property:

• Refractive Index: 1.4710-1.4750
• PSA: 29.54000
• LogP: 2.33880
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 233.06636305
• Heavy Atom Count: 16
• Complexity: 247

Purity/Quality:

97% ^*data from raw suppliers

N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C(=O)C1=CC=C(C=C1)C(F)(F)F)OC

Technology Process of N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide

There total 13 articles about N-Methoxy-N-methyl-4-(trifluoromethyl)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%

4-trifluoromethylbenzoic acid (455-24-3) + N,O-dimethylhydroxylamine*hydrochloride (6638-79-5) → N-methoxy-N-methyl-4-trifluoromethylbenzamide (116332-61-7)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 2h;

Reference yield: 100.0%

N,O-dimethylhydroxylamine*hydrochloride (6638-79-5) + 4-trifluoromethyl-phenyl acetyl chloride (329-15-7) → N-methoxy-N-methyl-4-trifluoromethylbenzamide (116332-61-7)

Guidance literature:

With pyridine; In tetrahydrofuran; at 0 - 20 ℃; for 2h;

DOI:10.1016/j.bmcl.2007.04.105

Reference yield: 96.0%

→ N-methoxy-N-methyl-4-trifluoromethylbenzamide (116332-61-7)

Guidance literature:

upstream raw materials:

S-methyldibenzothiophenium tetrafluoroborate

N,O-dimethylhydroxylamine*hydrochloride

4-trifluoromethyl-phenyl acetyl chloride

dibenzothiophene

Downstream raw materials:

2-<2-(4-trifluoromethylbenzoyl)ethyl>-1,3-dioxolane

cyclopropyl 4-(trifluoromethyl)-phenyl ketone

1-cyclopropyl-1-[4-(trifluoromethyl)phenyl]methanamine

2-<4-(trifluoromethyl)phenyl>pyrrole