((Cyclopentyloxy)methyl)benzene

Base Information

• Chemical Name: ((Cyclopentyloxy)methyl)benzene
• CAS No.: 40843-99-0
• Molecular Formula: C12H16O
• Molecular Weight: 176.258
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID20521328
• Nikkaji Number: J1.782.936J
• Wikidata: Q82385738
• Mol file: 40843-99-0.mol

Synonyms:(Cyclopentyloxymethyl)benzene;40843-99-0;((Cyclopentyloxy)methyl)benzene;cyclopentyloxymethylbenzene;[(cyclopentyloxy)methyl]benzene;benzyl cyclopentyl ether;SCHEMBL355570;DTXSID20521328;MFCD16295098;AKOS006332997;BS-22569;CS-0452251

Chemical Property of ((Cyclopentyloxy)methyl)benzene

Chemical Property:

• PSA: 9.23000
• LogP: 3.14580
• Storage Temp.: Room temperature.
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 176.120115130
• Heavy Atom Count: 13
• Complexity: 132

Purity/Quality:

≥95% ^*data from raw suppliers

(Cyclopentyloxymethyl)benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(C1)OCC2=CC=CC=C2

Technology Process of ((Cyclopentyloxy)methyl)benzene

There total 7 articles about ((Cyclopentyloxy)methyl)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: 96.0%

Cyclopentanol (96-41-3) + benzyl bromide (100-39-0) → [(cyclopentyloxy)methyl]benzene (40843-99-0)

Guidance literature:

With potassium hydride; In tetrahydrofuran; at 20 ℃; Inert atmosphere;

DOI:10.1016/j.tetlet.2010.04.129

Reference yield: 69.0%

Cyclopentanol (96-41-3) + toluene (108-88-3,15644-74-3,16713-13-6) → [(cyclopentyloxy)methyl]benzene (40843-99-0)

Guidance literature:

With tetrachloromethane; bis(acetylacetonate)oxovanadium; triethylamine; at 175 ℃; for 10h; Inert atmosphere; Autoclave;

DOI:10.1134/S0965544112040044

Reference yield: 55.0%

Cyclopentanol (96-41-3) + benzyl alcohol (100-51-6,185532-71-2) → dibenzyl ether (103-50-4) + [(cyclopentyloxy)methyl]benzene (40843-99-0)

Guidance literature:

With copper(ll) bromide; at 175 ℃; for 10h; Inert atmosphere; Sealed tube;

DOI:10.1134/S1070428018080055

upstream raw materials:

benzyl bromide

sodium cyclopentanolate

Cyclopentyl bromide

((penta-1,4-dien-3-yloxy)methyl)benzene

Downstream raw materials:

cyclopentanone

benzaldehyde

cyclopentyl benzoate

Refernces

• 1、 Khusnutdinov,Bayguzina,Gallyamova,Dzhemilev. "A novel method for synthesis of benzyl alkyl ethers using Vanadium-based metal complex catalysts". . p. 261 - 266. Retrieved 2012/10/29.
• 2、 Strazzolini, Paolo,Runcio, Antonio. "Oxidation of benzylic alcohols and ethers to carbonyl derivatives by nitric acid in dichloromethane". . p. 526 - 536. Retrieved 2007/10/03.