1 8-Diphenoxyoctane

Base Information

• Chemical Name: 1 8-Diphenoxyoctane
• CAS No.: 61575-01-7
• Molecular Formula: C20H26O2
• Molecular Weight: 298.425
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID40514777
• Wikidata: Q82375307
• Mol file: 61575-01-7.mol

Synonyms:1 8-DIPHENOXYOCTANE;61575-01-7;8-phenoxyoctoxybenzene;[(8-phenoxyoctyl)oxy]benzene;1,8-DIPHENOXYOCTANE;SCHEMBL9011860;DTXSID40514777;Octamethyylene glycol diphenyl ether;1,1'-[Octane-1,8-diylbis(oxy)]dibenzene;FT-0640764

Chemical Property of 1 8-Diphenoxyoctane

Chemical Property:

• Boiling Point: 431.1±28.0 °C(Predicted)
• PSA: 18.46000
• Density: 1.003±0.06 g/cm3(Predicted)
• LogP: 5.48500
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 11
• Exact Mass: 298.193280068
• Heavy Atom Count: 22
• Complexity: 216

Purity/Quality:

98%Min ^*data from raw suppliers

1 8-DIPHENOXYOCTANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCCCCCCCCOC2=CC=CC=C2

Technology Process of 1 8-Diphenoxyoctane

There total 7 articles about 1 8-Diphenoxyoctane 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: 84.0%

cyclohexenone (930-68-7) + 1,8-Octanediol (629-41-4) → 1,8-diphenoxyoctane (61575-01-7)

Guidance literature:

With iodine; dimethyl sulfoxide; In nitromethane; at 130 ℃; for 36h; Schlenk technique; Sealed tube;

DOI:10.1002/cjoc.201700743

Reference yield:

4-bromophenyl butyl ether (1200-03-9) → 1,8-diphenoxyoctane (61575-01-7)

Guidance literature:

With α-picoline; manganese; trifluoroacetic acid; cobalt(II) bromide; In acetonitrile; at 50 ℃;

DOI:10.1002/adsc.201600213

Reference yield:

(4-phenoxybutyl)magnesium bromide → 1,8-diphenoxyoctane (61575-01-7)

Guidance literature:

With ethyl acetate; In diethyl ether; Heating;

upstream raw materials:

1,8-dichlorooctane

sodium phenoxide

1,8-dibromooctane

4-phenoxybutyl iodide

Downstream raw materials:

1,8-diiodooctane