1-(Benzyloxy)octan-2-OL

Base Information

• Chemical Name: 1-(Benzyloxy)octan-2-OL
• CAS No.: 100011-00-5
• Molecular Formula: C15H24O2
• Molecular Weight: 236.354
• DSSTox Substance ID: DTXSID90547338
• Mol file: 100011-00-5.mol

Synonyms:1-(BENZYLOXY)OCTAN-2-OL;100011-00-5;1-phenylmethoxyoctan-2-ol;DTXSID90547338

Chemical Property of 1-(Benzyloxy)octan-2-OL

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 236.177630004
• Heavy Atom Count: 17
• Complexity: 164

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(COCC1=CC=CC=C1)O

Technology Process of 1-(Benzyloxy)octan-2-OL

There total 7 articles about 1-(Benzyloxy)octan-2-OL 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: 65.0%

1,2-Epoxyoctane (2984-50-1) + benzyl alcohol (100-51-6,185532-71-2) → 1-(benzyloxy)octan-2-ol (100011-00-5)

Guidance literature:

With organotin phosphate; In hexane; for 15h; Heating;

DOI:10.1016/S0040-4039(00)98156-5

Reference yield: 47.0%

1,2-octandiol (1117-86-8) + benzyl bromide (100-39-0) → 1-(benzyloxy)octan-2-ol (100011-00-5)

Guidance literature:

1,2-octandiol; With sodium hydride; In tetrahydrofuran; N,N-dimethyl-formamide; at 0 ℃; for 2h; Inert atmosphere;

benzyl bromide; In tetrahydrofuran; N,N-dimethyl-formamide; at 0 - 20 ℃; for 12h; regioselective reaction; Inert atmosphere;

DOI:10.1016/j.tetlet.2011.03.101

Reference yield:

n-hexylzirconocene chloride + benzyloxyacetoaldehyde (60656-87-3) → 1-(benzyloxy)octan-2-ol (100011-00-5)

Guidance literature:

With chromium dichloride; In tetrahydrofuran; at 27 - 29 ℃; for 20h; Irradiation;

DOI:10.1021/acs.orglett.0c03180

upstream raw materials:

1,2-Epoxyoctane

benzyl alcohol

1,2-octandiol

benzyl bromide

Downstream raw materials:

1-(benzyloxy)octan-2-one

((2,2-difluorooctyloxy)methyl)benzene