[(9-Bromononyl)oxy]benzene

Base Information

• Chemical Name: [(9-Bromononyl)oxy]benzene
• CAS No.: 52176-62-2
• Molecular Formula: C15H23BrO
• Molecular Weight: 299.251
• DSSTox Substance ID: DTXSID20493753
• Wikidata: Q82340674
• Mol file: 52176-62-2.mol

Synonyms:9-PHENOXYNONYL BROMIDE;52176-62-2;[(9-BROMONONYL)OXY]BENZENE;DTXSID20493753

Chemical Property of [(9-Bromononyl)oxy]benzene

Chemical Property:

• Boiling Point: 137-140 °C(Press: 0.5 Torr)
• PSA: 9.23000
• Density: 1.156±0.06 g/cm3(Predicted)
• LogP: 5.19100
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 298.09323
• Heavy Atom Count: 17
• Complexity: 155

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCCCCCCCCCBr

Technology Process of [(9-Bromononyl)oxy]benzene

There total 2 articles about [(9-Bromononyl)oxy]benzene 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: 50.0%

1,9-Dibromononane (4549-33-1) + sodium phenoxide (139-02-6) → (9-bromo-nonyl)-phenyl ether (52176-62-2)

Guidance literature:

In ethanol; at 65 - 80 ℃; for 48h;

DOI:10.1007/s00044-012-0090-2

Reference yield: 47.0%

1,9-Dibromononane (4549-33-1) + phenol (108-95-2,27073-41-2) → (9-bromo-nonyl)-phenyl ether (52176-62-2)

Guidance literature:

phenol; With sodium; In tetrahydrofuran; at 20 ℃; for 18h;

1,9-Dibromononane; In ethanol; for 48h; Reflux;

DOI:10.1039/c8sm00590g

Reference yield: 89.0%

(9-bromo-nonyl)-phenyl ether (52176-62-2) + 5-bromo-1,2,3 trihydroxybenzene (16492-75-4) → C51H71BrO6

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 16h;

DOI:10.1039/c8sm00590g

upstream raw materials:

1,9-Dibromononane

phenol

sodium phenoxide

Downstream raw materials:

10-phenoxy-decanoic acid

11-Phenoxyundecanoic acid

1-[2-Hydroxy-6-(9-phenoxy-nonyloxy)-phenyl]-ethanone

C₁₉H₃₂N₂O