1-Nitro-3-(2-phenoxyethoxy)benzene

Base Information

• Chemical Name: 1-Nitro-3-(2-phenoxyethoxy)benzene
• CAS No.: 17414-75-4
• Molecular Formula: C₁₄H₁₃NO₄
• Molecular Weight: 259.262
• NSC Number: 161085
• DSSTox Substance ID: DTXSID70303777
• Wikidata: Q82049235
• Mol file: 17414-75-4.mol

Synonyms:17414-75-4;1-nitro-3-(2-phenoxyethoxy)benzene;NSC161085;DTXSID70303777;AKOS017030266;NSC-161085

Chemical Property of 1-Nitro-3-(2-phenoxyethoxy)benzene

Chemical Property:

• Vapor Pressure: 4.61E-07mmHg at 25°C
• Boiling Point: 425.8°Cat760mmHg
• Flash Point: 189.5°C
• Density: 1.233g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 259.08445790
• Heavy Atom Count: 19
• Complexity: 273

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)[N+](=O)[O-]

Technology Process of 1-Nitro-3-(2-phenoxyethoxy)benzene

There total 2 articles about 1-Nitro-3-(2-phenoxyethoxy)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:

meta-nitrophenol (554-84-7) + phenoxyethyl bromide (589-10-6) → m-Nitrophenyl-phenoxyethylether (17414-75-4)

Guidance literature:

With sodium methylate;

DOI:10.1002/jps.2600560717

Reference yield:

phenol (108-95-2,27073-41-2) → m-Nitrophenyl-phenoxyethylether (17414-75-4)

Guidance literature:

Multi-step reaction with 2 steps

1: base

2: 1.) sodium / 1.) ethanol, RT, 0.5 h, 2.) ethanol, reflux, 21 h

With sodium;

DOI:10.1021/jm00343a011

Reference yield:

m-Nitrophenyl-phenoxyethylether (17414-75-4) → 3-(2-phenoxyethoxy)-benzenamine (79808-16-5)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal;

DOI:10.1002/jps.2600560717

upstream raw materials:

meta-nitrophenol

phenoxyethyl bromide

phenol

Downstream raw materials:

3-(2-phenoxyethoxy)-benzenamine

4-Hydroxy-7-(2-phenoxy-ethoxy)-quinoline-3-carboxylic acid

4-Hydroxy-7-(2-phenoxy-ethoxy)-quinoline-3-carboxylic acid ethyl ester