Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)-

Base Information

• Chemical Name: Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)-
• CAS No.: 3705-62-2
• Molecular Formula: C36H26O5
• Molecular Weight: 538.599
• European Community (EC) Number: 223-048-6
• UNII: MTV49UT8Q8
• DSSTox Substance ID: DTXSID1063146
• Nikkaji Number: J205.622D
• Wikidata: Q81990517
• Mol file: 3705-62-2.mol

Synonyms:3705-62-2;1,1'-Oxybis(m-(m-phenoxyphenoxy)benzene);Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)-;EINECS 223-048-6;1,1'-oxybis[m-(m-phenoxyphenoxy)benzene];Benzene, 1,1'-oxybis(3-(3-phenoxyphenoxy)-;MTV49UT8Q8;SCHEMBL1173869;DTXSID1063146;C36H26O5;bis(m-(m-phenoxy phenoxy)phenyl)ether;Bis[m-(m-phenoxyphenoxy)phenyl] ether;Bis[3-(3-phenoxyphenoxy)phenyl] ether;C36-H26-O5;1,1'-Oxybis[3-(3-phenoxyphenoxy)benzene]

Chemical Property of Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)-

Chemical Property:

• Boiling Point: 644.3 °C at 760 mmHg
• Flash Point: 247.4 °C
• PSA: 46.15000
• Density: 1.217 g/cm³
• LogP: 10.64810
• XLogP3: 9.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 538.17802393
• Heavy Atom Count: 41
• Complexity: 674

Purity/Quality:

99%, ^*data from raw suppliers

OS-138 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC(=CC=C3)OC4=CC=CC(=C4)OC5=CC=CC(=C5)OC6=CC=CC=C6

Technology Process of Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)-

There total 5 articles about Benzene, 1,1'-oxybis[3-(3-phenoxyphenoxy)- 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:

meta-phenoxyphenol (713-68-8) → 1,1'-oxybis[m-(m-phenoxyphenoxy)benzene] (3705-62-2)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) aq. KOH, (ii) /BRN= 1904538/, Cu, (heating)

2: (i) aq. KOH, (ii) /BRN= 1990418/, Cu, (heating)

DOI:10.1021/jo01079a029

Reference yield:

1-methoxy-3-phenoxybenzene (1655-68-1) → 1,1'-oxybis[m-(m-phenoxyphenoxy)benzene] (3705-62-2)

Guidance literature:

Multi-step reaction with 3 steps

1: aq. HBr, AcOH, Ac₂O

2: (i) aq. KOH, (ii) /BRN= 1904538/, Cu, (heating)

3: (i) aq. KOH, (ii) /BRN= 1990418/, Cu, (heating)

With hydrogen bromide; acetic anhydride; acetic acid;

DOI:10.1021/jo01079a029

Reference yield:

4′,6′-bis([1,1′-biphenyl]-4-yloxy)-5′-bromo-1,1′:3′,1″-terphenyl (23840-43-9) → 1,1'-oxybis[m-(m-phenoxyphenoxy)benzene] (3705-62-2)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. KOH / bis-(2-hydroxy-ethyl) ether / 230 - 240 °C

2: (i) aq. KOH, (ii) /BRN= 1990418/, Cu, (heating)

With potassium hydroxide; In diethylene glycol;

DOI:10.1021/jo01079a029

upstream raw materials:

4′,6′-bis([1,1′-biphenyl]-4-yloxy)-5′-bromo-1,1′:3′,1″-terphenyl

m-(m-phenoxyphenoxy)phenol

meta-phenoxyphenol

1-methoxy-3-phenoxybenzene