1-(2-Bromoethoxy)-3,5-dimethylbenzene

Base Information

• Chemical Name: 1-(2-Bromoethoxy)-3,5-dimethylbenzene
• CAS No.: 37136-93-9
• Molecular Formula: C10H13 Br O
• Molecular Weight: 229.11
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID90368944
• Wikidata: Q82155855
• Mol file: 37136-93-9.mol

Synonyms:1-(2-bromoethoxy)-3,5-dimethylbenzene;37136-93-9;1-(2-Bromo-ethoxy)-3,5-dimethyl-benzene;SCHEMBL5725587;DTXSID90368944;MFCD02030859;AKOS000199838;1-bromo-2-(3,5-dimethylphenoxy)ethane;AS-40667;BB 0217929;CS-0117204;FT-0677884;EN300-11703;1-(2-Bromoethoxy)-3,5-dimethylbenzene,97+%;Z57057715

Chemical Property of 1-(2-Bromoethoxy)-3,5-dimethylbenzene

Chemical Property:

• Vapor Pressure: 0.00405mmHg at 25°C
• Boiling Point: 288.5°Cat760mmHg
• Flash Point: 114.1°C
• PSA: 9.23000
• Density: 1.304g/cm³
• LogP: 3.07710
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 228.01498
• Heavy Atom Count: 12
• Complexity: 117

Purity/Quality:

98%min ^*data from raw suppliers

1-(2-Bromo-ethoxy)-3,5-dimethyl-benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1)OCCBr)C

Technology Process of 1-(2-Bromoethoxy)-3,5-dimethylbenzene

There total 2 articles about 1-(2-Bromoethoxy)-3,5-dimethylbenzene 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:

ethylene dibromide (106-93-4) + 3,5-Dimethylphenol (108-68-9,50356-23-5) → 1-bromo-2-(3,5-dimethylphenoxy)ethane (37136-93-9)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/jm00337a015

Reference yield:

sodium 3,5-dimethylphenolate (37621-81-1) + ethylene dibromide (106-93-4) → 1-bromo-2-(3,5-dimethylphenoxy)ethane (37136-93-9)

Guidance literature:

DOI:10.1021/ja01165a004

Reference yield: 98.0%

1-bromo-2-(3,5-dimethylphenoxy)ethane (37136-93-9) → C10H13N3O

Guidance literature:

With sodium azide; In N,N-dimethyl-formamide; at 65 ℃; for 4h;

DOI:10.1021/jacs.6b01852

upstream raw materials:

sodium 3,5-dimethylphenolate

ethylene dibromide

3,5-Dimethylphenol

Downstream raw materials:

4-(2-bromo-ethoxy)-2,6-dimethyl-benzenesulfonyl chloride

[2-(3,5-dimethyl-phenoxy)-ethyl]-trimethyl-ammonium; bromide

2-(3,5-Dimethyl-phenoxy)-ethylhydrazin

Refernces

• 1、 DRAIN,HOWES,LAZARE,SALAMAN,SHADBOLT,WILLIAMS. "MONOAMINE OXIDASE INHIBITORS. THE SYNTHESIS AND EVALUATION OF A SERIES". . p. 63 - 69. Retrieved 2007/10/05.