[2-Bromo-1-(propan-2-yloxy)ethyl]benzene

Base Information

• Chemical Name: [2-Bromo-1-(propan-2-yloxy)ethyl]benzene
• CAS No.: 63785-56-8
• Molecular Formula: C11H15BrO
• Molecular Weight: 243.143
• DSSTox Substance ID: DTXSID30505199
• Nikkaji Number: J2.451.637G

Synonyms:[2-bromo-1-(propan-2-yloxy)ethyl]benzene;63785-56-8;(2-bromo-1-propan-2-yloxyethyl)benzene;DTXSID30505199;AKOS011393600;{2-Bromo-1-[(propan-2-yl)oxy]ethyl}benzene;EN300-220005

Chemical Property of [2-Bromo-1-(propan-2-yloxy)ethyl]benzene

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 242.03063
• Heavy Atom Count: 13
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(CBr)C1=CC=CC=C1

Technology Process of [2-Bromo-1-(propan-2-yloxy)ethyl]benzene

There total 4 articles about [2-Bromo-1-(propan-2-yloxy)ethyl]benzene 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: 87.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + isopropyl alcohol (67-63-0,8013-70-5) → 1-phenyl-1-isopropoxy-2-bromoethane (63785-56-8)

Guidance literature:

With N,N'-dibromo-N,N'-(1,2-ethanediyl)bis(p-toluenesulfonamide); ammonium acetate; at 20 ℃; for 0.1h;

DOI:10.5012/bkcs.2013.34.2.500

Reference yield:

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + isopropyl alcohol (67-63-0,8013-70-5) → 1-phenyl-1-isopropoxy-2-bromoethane (63785-56-8) + (1,2-dibromoethyl)benzene (102921-26-6,93-52-7)

Guidance literature:

With Oxone; ammonium bromide; at 20 ℃; for 24h;

DOI:10.1080/00397911.2012.761238

Reference yield:

isopropyl alcohol (67-63-0,8013-70-5) → 1-phenyl-1-isopropoxy-2-bromoethane (63785-56-8) + 3-Bromo-3-phenyl-propionic acid isopropyl ester (77085-23-5) + 3-Isopropoxy-3-phenyl-propionic acid isopropyl ester (77085-22-4) + (1,2-dibromoethyl)benzene (102921-26-6,93-52-7)

Guidance literature:

With bromine;

DOI:10.1016/S0040-4039(00)92190-7

upstream raw materials:

styrene

isopropyl alcohol

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