N-(3-bromophenyl)-2-methoxyacetamide

Base Information

• Chemical Name: N-(3-bromophenyl)-2-methoxyacetamide
• CAS No.: 430463-83-5
• Molecular Formula: C9H10BrNO2
• Molecular Weight: 244.088
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID70358308
• Wikidata: Q82138785
• ChEMBL ID: CHEMBL1486040
• Mol file: 430463-83-5.mol

Synonyms:N-(3-bromophenyl)-2-methoxyacetamide;430463-83-5;MLS000062626;HMS2359I05;Cambridge id 6637255;SCHEMBL2800153;CHEMBL1486040;DTXSID70358308;MFCD03139019;STK120391;AKOS000193446;SDCCGMLS-0042350.P002;BS-38161;SMR000071163;AB00113424-01;SR-01000239862;SR-01000239862-1

Chemical Property of N-(3-bromophenyl)-2-methoxyacetamide

Chemical Property:

• Vapor Pressure: 1.28E-05mmHg at 25°C
• Boiling Point: 368.4°C at 760 mmHg
• Flash Point: 176.6°C
• PSA: 41.82000
• Density: 1.51g/cm³
• LogP: 2.68350
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 242.98949
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

99% ^*data from raw suppliers

N-(3-bromophenyl)-2-methoxyacetamide 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCC(=O)NC1=CC(=CC=C1)Br

Technology Process of N-(3-bromophenyl)-2-methoxyacetamide

There total 3 articles about N-(3-bromophenyl)-2-methoxyacetamide 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: 81.0%

2-methoxyacetic acid (625-45-6) + m-Bromoaniline (591-19-5) → N-(3-bromophenyl)-2-methoxyacetamide (430463-83-5)

Guidance literature:

With dicyclohexyl-carbodiimide; In dichloromethane;

DOI:10.1021/jo701387m

Reference yield:

Methoxyacetyl chloride (38870-89-2) + m-Bromoaniline (591-19-5) → N-(3-bromophenyl)-2-methoxyacetamide (430463-83-5)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 15 ℃; for 2h;

Reference yield:

m-Bromoaniline (591-19-5) → N-(3-bromophenyl)-2-methoxyacetamide (430463-83-5)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 5 h / 20 °C

2: sodium / 2 h / 60 °C

With sodium; triethylamine; In dichloromethane;

upstream raw materials:

2-methoxyacetic acid

m-Bromoaniline

Methoxyacetyl chloride