N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl

Base Information

• Chemical Name: N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl
• CAS No.: 50622-52-1
• Molecular Formula: C8H11BrN2
• Molecular Weight: 215.093
• DSSTox Substance ID: DTXSID301290491
• Nikkaji Number: J1.220.107I
• Mol file: 50622-52-1.mol

Synonyms:50622-52-1;N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl;SCHEMBL11236781;DTXSID301290491;AKOS011852360;N'-(4-bromophenyl)ethane-1,2-diamine;N1-(4-Bromophenyl)-1,2-ethanediamine

Chemical Property of N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 214.01056
• Heavy Atom Count: 11
• Complexity: 100

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NCCN)Br

Technology Process of N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl

There total 3 articles about N1-(4-Bromophenyl)-1,2-ethanediamine 2HCl 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: 45.0%

1.4-dibromobenzene (106-37-6) + ethylenediamine (107-15-3,85404-18-8) → N1-(4-bromophenyl)ethane-1,2-diamine (50622-52-1)

Guidance literature:

With sodium t-butanolate; 1,1'-bis-(diphenylphosphino)ferrocene; tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; In 1,4-dioxane; Heating;

DOI:10.1055/s-1999-2837

Reference yield:

1,4-bromoiodobenzene (589-87-7) + ethylenediamine (107-15-3,85404-18-8) → N1-(4-bromophenyl)ethane-1,2-diamine (50622-52-1)

Guidance literature:

With copper(l) iodide; In 1,2-dimethoxyethane; isopropyl alcohol; for 12h; Reflux;

DOI:10.1016/j.dyepig.2013.06.027

Reference yield:

2-bromoethylamine hydrobromide (2576-47-8) + 4-bromo-aniline (106-40-1) → N1-(4-bromophenyl)ethane-1,2-diamine (50622-52-1)

Guidance literature:

In toluene; for 5h; Reflux;

DOI:10.1021/acsmedchemlett.6b00330 DOI:10.1021/acsmedchemlett.8b00177

upstream raw materials:

1.4-dibromobenzene

ethylenediamine

1,4-bromoiodobenzene

2-bromoethylamine hydrobromide

Downstream raw materials:

N⁽¹⁾-(4-bromophenyl)-N⁽²⁾,N⁽²⁾-bis(pyridin-2-ylmethyl)ethane-1,2-diamine

1-Phenoxy-2-hydroxy-3-<2-(4-bromphenylamino)ethyl>aminopropan

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