1,3-Diphenoxypropane

Base Information

• Chemical Name: 1,3-Diphenoxypropane
• CAS No.: 726-44-3
• Molecular Formula: C15H16O2
• Molecular Weight: 228.291
• European Community (EC) Number: 667-842-4
• NSC Number: 6801
• DSSTox Substance ID: DTXSID20222924
• Nikkaji Number: J136.486C
• Wikidata: Q83101282
• Mol file: 726-44-3.mol

Synonyms:1,3-Diphenoxypropane;3-phenoxypropoxybenzene;726-44-3;Benzene, 1,1'-(1,3-propanediylbis(oxy))bis-;Benzene, 1,1'-[1,3-propanediylbis(oxy)]bis-;(3-phenoxypropoxy)benzene;NSC6801;Cambridge id 5359462;SCHEMBL1025;DTXSID20222924;NSC 6801;NSC-6801;AKOS000359835;CS-0358036

Chemical Property of 1,3-Diphenoxypropane

Chemical Property:

• Melting Point: 62°C
• Refractive Index: 1.5542 (estimate)
• Boiling Point: 339.6°Cat760mmHg
• Flash Point: 132.5°C
• PSA: 18.46000
• Density: 1.062g/cm³
• LogP: 3.53450
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 228.115029749
• Heavy Atom Count: 17
• Complexity: 161

Purity/Quality:

99%min ^*data from raw suppliers

1,3-Diphenoxypropane 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCCCOC2=CC=CC=C2

Technology Process of 1,3-Diphenoxypropane

There total 6 articles about 1,3-Diphenoxypropane 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: 77.0%

3-phenoxypropanol (6180-61-6) + 2-(trimethylsilyl)phenyl trifluoromethanesulfonate (88284-48-4) → 1,3-diphenoxypropane (726-44-3)

Guidance literature:

With potassium fluoride; 18-crown-6 ether; In tetrahydrofuran; at -20 ℃; for 12h; Inert atmosphere; Sealed tube;

DOI:10.1039/c5cc08307a

Reference yield:

1,3-dibromo-propane (109-64-8) + phenol (108-95-2,27073-41-2) → 1,3-diphenoxypropane (726-44-3)

Guidance literature:

DOI:10.1039/jr9650005718

Reference yield:

propane-1,3-diol ditosylate (5469-66-9) + phenol (108-95-2,27073-41-2) → 1,3-diphenoxypropane (726-44-3)

Guidance literature:

With sodium hydroxide; In water; Heating;

upstream raw materials:

1,3-Diiodopropane

sodium phenoxide

1,3-dibromo-propane

phenol

Downstream raw materials:

1,3-bis(4-formylphenoxy)propane

4,4-[1,3-propanediylbis(oxy)]bisbenzeneacetonitrile

1,3-bis(4-benzoylphenoxy)propane

1,3-Bis(4-benzoylphenoxy)propane dioxime

Refernces

• 1、 Thangaraj, Manikandan,Bhojgude, Sachin Suresh,Mane, Manoj V.,Biju, Akkattu T.. "From insertion to multicomponent coupling: Temperature dependent reactions of arynes with aliphatic alcohols". supporting information. p. 1665 - 1668. Retrieved 2016/01/30.
• 2、 Baliah, V.,Aparajithan, K.. "Dipole Moments and UV Spectra of some Long-chain Molecules". . p. 255 - 259. Retrieved 2007/10/02.