p-Octadecyloxynitrobenzene

Base Information

• Chemical Name: p-Octadecyloxynitrobenzene
• CAS No.: 123974-61-8
• Molecular Formula: C24H41 N O3
• Molecular Weight: 391.594
• DSSTox Substance ID: DTXSID60401317
• Wikidata: Q82204398
• Mol file: 123974-61-8.mol

Synonyms:p-Nitrophenyl octadecyl ether;p-Octadecyloxynitrobenzene;123974-61-8;1-nitro-4-octadecoxybenzene;1-nitro-4-(octadecyloxy)benzene;4-Nitrophenyl octadecyl ether;DTXSID60401317;MFCD00024681;AKOS015839813;AS-60031;FT-0676045;D96025

Chemical Property of p-Octadecyloxynitrobenzene

Chemical Property:

• Vapor Pressure: 1.32E-09mmHg at 25°C
• Refractive Index: 1.494
• Boiling Point: 499.1°C at 760 mmHg
• Flash Point: 158.7°C
• PSA: 55.05000
• Density: 0.964g/cm³
• LogP: 8.75830
• XLogP3: 10.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 18
• Exact Mass: 391.30864417
• Heavy Atom Count: 28
• Complexity: 348

Purity/Quality:

97% ^*data from raw suppliers

p-NitrophenylOctadecylEther ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]

Technology Process of p-Octadecyloxynitrobenzene

There total 3 articles about p-Octadecyloxynitrobenzene 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: 98.0%

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + 1-Bromooctadecane (112-89-0) → 1-nitro-4-(n-octadecyloxy)benzene (123974-61-8)

Guidance literature:

With 18-crown-6 ether; tetra-(n-butyl)ammonium iodide; potassium carbonate; In acetonitrile; at 80 ℃; Inert atmosphere;

DOI:10.1039/c1cc13099d

Reference yield:

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + n-octadecyl p-toluenesulfonate (3386-32-1) → 1-nitro-4-(n-octadecyloxy)benzene (123974-61-8)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01145a147

Reference yield:

1-chlorooctadecane (3386-33-2) + 4-(4-nitrophenoxy)butanoic acid (28341-54-0) → 1-nitro-4-(n-octadecyloxy)benzene (123974-61-8)

Guidance literature:

With Tetrahydrofurfuryl alcohol; potassium iodide; at 140 ℃;

upstream raw materials:

4-nitro-phenol

n-octadecyl p-toluenesulfonate

1-chlorooctadecane

4-(4-nitrophenoxy)butanoic acid

Downstream raw materials:

(E)-4,4'-dimethylazobenzene

4-hydroxy-4'(4-octadecyloxy)diazobenzene

4-(octadecyloxy)aniline

N-(4-(octadecyloxy)phenyl)acetamide

Refernces

• 1、 Gowda, Ashwathanarayana,Roy, Arun,Kumar, Sandeep. "Synthesis and mesomorphic properties of novel Schiff base liquid crystalline EDOT derivatives". . p. 840 - 847. Retrieved 2016/12/30.
• 2、 Cheng, Xiaohong,Jin, Jie,Li, Quan,Dong, Xing. "Hydrogen bonded supramolecular liquid crystalline complex of 2,4,6-triarylamino-1,3,5-triazines with semiperfluorinated benzoic acids". experimental part. p. 1957 - 1962. Retrieved 2011/06/19.