Benzyl 5-Bromoamyl Ether

Base Information

• Chemical Name: Benzyl 5-Bromoamyl Ether
• CAS No.: 1014-93-3
• Molecular Formula: C12H17 Br O
• Molecular Weight: 257.17
• European Community (EC) Number: 678-190-5
• DSSTox Substance ID: DTXSID80557562
• Nikkaji Number: J2.645.240F
• Wikidata: Q82439508
• Mol file: 1014-93-3.mol

Synonyms:1014-93-3;Benzyl 5-Bromoamyl Ether;Benzyl 5-Bromopentyl Ether;(((5-Bromopentyl)oxy)methyl)benzene;Benzene, [[(5-bromopentyl)oxy]methyl]-;5-bromopentoxymethylbenzene;1-(Benzyloxy)-5-bromopentane;((5-bromopentyloxy)methyl)benzene;{[(5-bromopentyl)oxy]methyl}benzene;MFCD02258456;(5-Bromopentyloxymethyl)benzene;[[(5-Bromopentyl)oxy]methyl]benzene;5-BENZYLOXY-1-BROMOPENTANE;Benzyloxypentyl Bromide;5-bromopentylbenzylether;5-benzyloxypentyl bromide;5-bromopentyl benzyl ether;1-bromo-5-benzyloxy pentane;5-benzyloxy-1-bromo-pentane;SCHEMBL1309167;DTXSID80557562;BAA01493;AKOS013523885;AS-10488;SY054763;B2819;CS-0132768;EN300-673887;T70013

Chemical Property of Benzyl 5-Bromoamyl Ether

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Refractive Index: 1.526
• Boiling Point: 303.757oC at 760 mmHg
• Flash Point: 135.31oC
• PSA: 9.23000
• Density: 1.24
• LogP: 3.76840
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: Dichloromethane
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 256.04628
• Heavy Atom Count: 14
• Complexity: 122

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-(Benzyloxy)-5-bromopentane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Benzyl 5-Bromoamyl Ether

There total 13 articles about Benzyl 5-Bromoamyl Ether 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: 99.0%

5-(benzyloxy)pentyl 4-methylbenzene-1-sulfonate (141177-22-2) → 1-(benzyloxy)-5-bromopentane (1014-93-3)

Guidance literature:

With sodium bromide; In N,N-dimethyl-formamide; at 45 ℃; for 5h; Inert atmosphere;

DOI:10.1016/j.jfluchem.2015.06.022

Reference yield: 98.0%

5-(benzyloxy)-1-pentanol (4541-15-5) → 1-(benzyloxy)-5-bromopentane (1014-93-3)

Guidance literature:

With carbon tetrabromide; tris(2,2'-bipyridyl)ruthenium(II) chloride hexahydrate; N,N-dimethyl-formamide; sodium bromide; at 25 - 30 ℃; Inert atmosphere; visible-light irradiation;

DOI:10.1038/nchem.949

Reference yield: 63.0%

1,5-dibromo-pentane (111-24-0) + benzyl alcohol (100-51-6,185532-71-2) → 1-(benzyloxy)-5-bromopentane (1014-93-3)

Guidance literature:

With tetrabutylammomium bromide; sodium hydroxide; In water; at 70 ℃; for 4h;

upstream raw materials:

5-(benzyloxy)-1-pentanol

5-(benzyloxy)pentyl 4-methylbenzene-1-sulfonate

1 ,5-pentanediol

benzyl bromide

Downstream raw materials:

(R)-1-(5-Benzyloxypentyl)-4-butylpyrrolidin-2-one

(2-((5-fluoropentyl)oxy)ethyl)benzene

(pent-4-en-1-yloxy)benzene

3-(5-benzyloxypentyl)pentanedioic acid diethyl ester

Refernces

• 1、 -. "LIPID PRODRUGS OF NEUROSTEROIDS". Page/Page column 00347. . Retrieved 2021/08/13.
• 2、 -. "LIPID PRODRUGS OF GLUCOCORTICOIDS AND USES THEREOF". Paragraph 00413. . Retrieved 2020/09/12.