N,N-Dimethyl-2-bromophenylethylamine

Base Information

• Chemical Name: N,N-Dimethyl-2-bromophenylethylamine
• CAS No.: 7438-76-8
• Molecular Formula: C₁₀H₁₄BrN
• Molecular Weight: 228.132
• DSSTox Substance ID: DTXSID70995898
• Wikidata: Q82987505
• ChEMBL ID: CHEMBL506244
• Mol file: 7438-76-8.mol

Synonyms:N,N-dimethyl-2-bromophenylethylamine;N,N-dimethyl-2-bromophenylethylamine hydrobromide

Chemical Property of N,N-Dimethyl-2-bromophenylethylamine

Chemical Property:

• Vapor Pressure: 0.0106mmHg at 25°C
• Boiling Point: 262.9°C at 760 mmHg
• Flash Point: 112.8°C
• PSA: 3.24000
• Density: 1.276g/cm³
• LogP: 2.68420
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 227.03096
• Heavy Atom Count: 12
• Complexity: 125

Purity/Quality:

2-(2-Bromophenyl)-N,N-dimethylethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCC1=CC=CC=C1Br

Technology Process of N,N-Dimethyl-2-bromophenylethylamine

There total 2 articles about N,N-Dimethyl-2-bromophenylethylamine 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:

2-dimethylamino-1-phenylethanol (6853-14-1) → N.N-Dimethyl-2-brom-2-phenyl-aethylamin (7438-76-8)

Guidance literature:

With phosphorus tribromide; In chloroform;

DOI:10.1039/jr9630001385

Reference yield:

2-dimethylamino-1-phenyl-ethanone (3319-03-7) → N.N-Dimethyl-2-brom-2-phenyl-aethylamin (7438-76-8)

Guidance literature:

Multi-step reaction with 2 steps

1: Al(OiPr)3 / propan-2-ol

2: PBr₃ / CHCl₃

With phosphorus tribromide; aluminum isopropoxide; In chloroform; isopropyl alcohol;

DOI:10.1039/jr9630001385

upstream raw materials:

2-dimethylamino-1-phenylethanol

2-dimethylamino-1-phenyl-ethanone