1-(2-Bromoethoxy)-4-tert-butylbenzene

Base Information

• Chemical Name: 1-(2-Bromoethoxy)-4-tert-butylbenzene
• CAS No.: 5952-59-0
• Molecular Formula: C12H17BrO
• Molecular Weight: 257.17
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID70364626
• Wikidata: Q82148687
• Mol file: 5952-59-0.mol

Synonyms:5952-59-0;1-(2-bromoethoxy)-4-tert-butylbenzene;2-Bromoethyl 4-(tert-butyl)phenyl ether;1-(2-bromoethoxy)-4-(tert-butyl)benzene;SCHEMBL1586530;DTXSID70364626;MFCD02030708;AKOS000199791;GA-0819;CS-0154895;FT-0681044;EN300-09344;D95018;A869182;J-502946;Z56346935

Chemical Property of 1-(2-Bromoethoxy)-4-tert-butylbenzene

Chemical Property:

• Vapor Pressure: 0.00191mmHg at 25°C
• Refractive Index: 1.519
• Boiling Point: 301.2 °C at 760 mmHg
• Flash Point: 119 °C
• PSA: 9.23000
• Density: 1.225 g/cm³
• LogP: 3.75780
• Storage Temp.: 2-8°C
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 256.04628
• Heavy Atom Count: 14
• Complexity: 154

Purity/Quality:

98%min ^*data from raw suppliers

2-Bromoethyl 4-(tert-butyl)phenyl ether ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-(2-Bromoethoxy)-4-tert-butylbenzene

There total 2 articles about 1-(2-Bromoethoxy)-4-tert-butylbenzene 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: 62.0%

para-tert-butylphenol (98-54-4) + ethylene dibromide (106-93-4) → p-(2-bromoethoxy)-tert-butylbenzene (5952-59-0)

Guidance literature:

With potassium carbonate; In acetonitrile; Reflux;

DOI:10.1016/j.bmcl.2017.03.028

Reference yield:

→ p-(2-bromoethoxy)-tert-butylbenzene (5952-59-0)

Guidance literature:

p-t.BuPhenol, Ethylenbromid, NaOH;

Reference yield: 69.2%

(2R,3R,4R,5S,6S)-2-(acetoxymethyl)-6-(4-chloro-3-(4-hydroxybenzyl)phenyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate (1079083-63-8) + p-(2-bromoethoxy)-tert-butylbenzene (5952-59-0) → C39H45ClO11

Guidance literature:

With tetrabutylammomium bromide; potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃;

upstream raw materials:

para-tert-butylphenol

ethylene dibromide

Downstream raw materials:

1-(4-tert-butyl-phenoxy)-2-(4-chloro-benzylsulfanyl)-ethane

2-({2-[2-(4-t-butylphenoxy)ethoxy]-4-pyridyl}methyl)tetrahydrofuran-2-furancarboxylic acid

2-({1-[2-(4-t-butylphenoxy)ethyl]-2-oxo-1,2-dihydro-4-pyridinyl}methyl)tetrahydrofuran-2-furancarboxylic acid

1-[3-(2-(4-tert-butylphenoxy)ethoxy)propyl]-3-methylpiperidine

Refernces

• 1、 Luan, Shenglin,Ge, Qi,Chen, Yedong,Dai, Mingyang,Yang, Jinyu,Li, Kun,Liu, Dan,Zhao, Linxiang. "Discovery and structure-activity relationship studies of N-substituted indole derivatives as novel Mcl-1 inhibitors". supporting information. p. 1943 - 1948. Retrieved 2017/04/07.
• 2、 Lazewska, Dorota,Kuder, Kamil,Ligneau, Xavier,Camelin, Jean-Claude,Schunack, Walter,Stark, Holger,Kiec-Kononowicz, Katarzyna. "Diether derivatives of homo- or substituted piperidines as non-imidazole histamine H3 receptor ligands". experimental part. p. 3037 - 3042. Retrieved 2009/09/30.