2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide

Base Information

• Chemical Name: 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide
• CAS No.: 3792-04-9
• Molecular Formula: C9H7 Cl F3 N O
• Molecular Weight: 237.609
• Hs Code.: 2924299090
• European Community (EC) Number: 654-985-2
• DSSTox Substance ID: DTXSID20353222
• Wikidata: Q82130695
• Mol file: 3792-04-9.mol

Synonyms:3792-04-9;2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide;2-Chloro-N-(2-(trifluoromethyl)phenyl)acetamide;n-(chloroacetyl)-2-(trifluoromethyl)aniline;n-chloroacetyl-2-(trifluoromethyl)aniline;MFCD00018893;2-chloro-N-(2-trifluoromethylphenyl)acetamide;SCHEMBL4006020;DTXSID20353222;JS-105C;STK325977;AKOS000265796;CS-0033863;EN300-01684;N-(2-trifluoromethylphenyl)-2-chloroacetamide;2-Chloro-N-(2-trifluoromethylphenyl) acetamide;C74939;A912854;Z56896251;F0266-3216;2-CHLORO-ALPHA,ALPHA,ALPHA-TRIFLUORO-ORTHO-ACETOTOLUIDIDE

Chemical Property of 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide

Chemical Property:

• Vapor Pressure: 0.000159mmHg at 25°C
• Melting Point: 92-94°C
• Refractive Index: 1.513
• Boiling Point: 205°Cat760mmHg
• PKA: 12.13±0.70(Predicted)
• Flash Point: 85°C
• PSA: 29.10000
• Density: 1.289g/cm³
• LogP: 2.95570
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 237.0168260
• Heavy Atom Count: 15
• Complexity: 232

Purity/Quality:

98%min ^*data from raw suppliers

N-Chloroacetyl-2-(trifluoromethyl)aniline 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCl

Technology Process of 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide

There total 2 articles about 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide 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: 80.0%

chloroacetyl chloride (79-04-9) + 2-(trifluoromethyl)benzenamine (88-17-5) → 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide (3792-04-9)

Guidance literature:

With potassium carbonate; In dichloromethane; for 4h; Heating;

DOI:10.1016/j.bmc.2007.01.055

Reference yield:

→ 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide (3792-04-9)

Guidance literature:

/BRN= 3319864/;

Reference yield: 94.0%

5,7-dihydroxy-2-phenyl-chromen-4-one (480-40-0) + 2-chloro-N-[2-(trifluoromethyl)phenyl]acetamide (3792-04-9) → 2-((5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-N-(2-(trifluoromethyl)phenyl)acetamide

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 24h;

DOI:10.3390/molecules25040888

upstream raw materials:

chloroacetyl chloride

2-(trifluoromethyl)benzenamine

Downstream raw materials:

2-(4-nitrophenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide

C₂₂H₂₃N₂O₅F₃

2-(4-aminophenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide

1-deoxy-1-[6-(4-{[2-(trifluoromethyl)phenylcarbamoyl]methoxy}phenylamino)-9H-purin-9-yl]-N-ethyl-2,3-O-(1-methylethylidene)-β-D-ribofuranuronamide

Refernces

• 1、 -. "Antidiabetic compounds". Page/Page column 13-14. . Retrieved 2020/06/16.
• 2、 Cai, Nan,Liu, Caixiu,Feng, Zhihui,Li, Xinghai,Qi, Zhiqiu,Ji, Mingshan,Qin, Peiwen,Ahmed, Wasim,Cui, Zining. "Design, synthesis, and SAR of novel 2-glycinamide cyclohexyl sulfonamide derivatives against botrytis cinerea". . . Retrieved 2018/04/02.