2-bromo-N-(2-phenylethyl)acetamide

Base Information

• Chemical Name: 2-bromo-N-(2-phenylethyl)acetamide
• CAS No.: 64297-92-3
• Molecular Formula: C10H12BrNO
• Molecular Weight: 242.115
• DSSTox Substance ID: DTXSID00432281
• Wikidata: Q27216153
• Mol file: 64297-92-3.mol

Synonyms:2-bromo-N-(2-phenylethyl)acetamide;64297-92-3;2-bromo-N-phenethylacetamide;2-bromo-N-phenethyl-acetamide;SCHEMBL6425753;DTXSID00432281;CHEBI:125537;MFCD06800319;STL070976;AKOS000319658;BS-38215;2-bromo-N-phenethyl-acetamide, AldrichCPR;CS-0326743;(r)-(+)-N-(2-phenylethyl)carbamoylmethylbromide;BRD-K33445737-001-01-1;Q27216153

Chemical Property of 2-bromo-N-(2-phenylethyl)acetamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 241.01023
• Heavy Atom Count: 13
• Complexity: 155

Purity/Quality:

99% ^*data from raw suppliers

2-Bromo-N-phenethylacetamide ^*data from reagent suppliers

Safty Information:

• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCNC(=O)CBr

Technology Process of 2-bromo-N-(2-phenylethyl)acetamide

There total 6 articles about 2-bromo-N-(2-phenylethyl)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: 71.0%

2-bromoacetyl chloride (22118-09-8) + phenethylamine (64-04-0) → N-(β-phenethyl)-2-bromoacetamide (64297-92-3)

Guidance literature:

With sodium hydroxide; at 10 ℃; for 1h;

DOI:10.1002/jps.2600740304

Reference yield:

phenethylamine (64-04-0) + 2-Bromoacetyl bromide (598-21-0) → N-(β-phenethyl)-2-bromoacetamide (64297-92-3)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 1h; Inert atmosphere;

DOI:10.1016/j.ejmech.2016.01.031

Reference yield:

2-chloro-N-phenethylacetamide (13156-95-1) → N-(β-phenethyl)-2-bromoacetamide (64297-92-3)

Guidance literature:

2-chloro-N-phenethylacetamide; With trimethylsilyl bromide; In chloroform-d1; at 36 ℃; for 24h; Inert atmosphere;

With acetone; In chloroform-d1; for 0.0833333h; Solvent; Time; Inert atmosphere;

DOI:10.3762/bjoc.16.119

upstream raw materials:

2-bromoacetyl chloride

phenethylamine

bromoacetic acid

2-Bromoacetyl bromide

Downstream raw materials:

3-carbamoyl-1-carbamoylmethyl>-1,4-dihydropyridine

C₂₀H₁₈N₂O₃