1-Pentanol, 5-[(4-methoxyphenyl)methoxy]-

Base Information

• Chemical Name: 1-Pentanol, 5-[(4-methoxyphenyl)methoxy]-
• CAS No.: 131375-63-8
• Molecular Formula: C13H20O3
• Molecular Weight: 224.3
• DSSTox Substance ID: DTXSID00442784
• Nikkaji Number: J1.370.811H
• Wikidata: Q82260275
• Mol file: 131375-63-8.mol

Synonyms:1-Pentanol, 5-[(4-methoxyphenyl)methoxy]-;131375-63-8;SCHEMBL6551488;DTXSID00442784;YRXFDWCHKRRPRI-UHFFFAOYSA-N;5-(4-Methoxybenzyloxy)-1-pentanol;5-(4-methoxy-benzyloxy)-pentan-1-ol

Chemical Property of 1-Pentanol, 5-[(4-methoxyphenyl)methoxy]-

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 224.14124450
• Heavy Atom Count: 16
• Complexity: 153

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)COCCCCCO

Technology Process of 1-Pentanol, 5-[(4-methoxyphenyl)methoxy]-

There total 10 articles about 1-Pentanol, 5-[(4-methoxyphenyl)methoxy]- 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: 100.0%

1 ,5-pentanediol (111-29-5) + p-methoxybenzyl chloride (824-94-2) → 5-(4-methoxybenzyloxy)-1-pentanol (131375-63-8)

Guidance literature:

1 ,5-pentanediol; With sodium hydride; In tetrahydrofuran; mineral oil; at 0 ℃; for 3h; Inert atmosphere; Reflux;

p-methoxybenzyl chloride; With tetra-(n-butyl)ammonium iodide; In tetrahydrofuran; mineral oil; at 20 ℃; for 12h; Inert atmosphere; Reflux;

DOI:10.1002/anie.201506366

Reference yield: 94.0%

1 ,5-pentanediol (111-29-5) + O-(4-methoxybenzyl)-trichloroacetimidate (89238-99-3) → 5-(4-methoxybenzyloxy)-1-pentanol (131375-63-8)

Guidance literature:

With trimethylsilyl trifluoromethanesulfonate; In acetonitrile; at -23 ℃; for 0.5h;

DOI:10.1021/ol051415y

Reference yield: 92.0%

1 ,5-pentanediol (111-29-5) + p-Methoxybenzyl bromide (2746-25-0) → 5-(4-methoxybenzyloxy)-1-pentanol (131375-63-8)

Guidance literature:

With sodium hydride; In tetrahydrofuran; at 0 - 6 ℃; for 6h;

DOI:10.1016/j.tetlet.2009.09.151

upstream raw materials:

1 ,5-pentanediol

p-Methoxybenzyl bromide

p-methoxybenzyl chloride

O-(4-methoxybenzyl)-trichloroacetimidate

Downstream raw materials:

5-(4-methoxy-benzyloxy)-pentanoic acid

1-[(5-bromopentyloxy)methyl]-4-methoxybenzene

1-{[(5-iodopentyl)oxy]methyl}-4-methoxybenzene

C₃₄H₆₀O₅Si