1-Methoxy-3-(4-nitrophenoxy)benzene

Base Information

• Chemical Name: 1-Methoxy-3-(4-nitrophenoxy)benzene
• CAS No.: 22479-76-1
• Molecular Formula: C13H11 N O4
• Molecular Weight: 245.235
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID80460562
• Nikkaji Number: J1.021.846B
• Wikidata: Q82284642
• Mol file: 22479-76-1.mol

Synonyms:1-methoxy-3-(4-nitrophenoxy)benzene;22479-76-1;1-methoxy-3-(4-nitrophenoxy) benzene;SCHEMBL11190066;DTXSID80460562;AKOS015964674;AKOS022172864;AC-21011

Chemical Property of 1-Methoxy-3-(4-nitrophenoxy)benzene

Chemical Property:

• Vapor Pressure: 5.15E-05mmHg at 25°C
• Refractive Index: 1.588
• Boiling Point: 358.7°C at 760 mmHg
• Flash Point: 154.7°C
• PSA: 64.28000
• Density: 1.252g/cm³
• LogP: 3.91890
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 245.06880783
• Heavy Atom Count: 18
• Complexity: 271

Purity/Quality:

99% ^*data from raw suppliers

1-Methoxy-3-(4-nitrophenoxy)benzene 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]

Technology Process of 1-Methoxy-3-(4-nitrophenoxy)benzene

There total 7 articles about 1-Methoxy-3-(4-nitrophenoxy)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: 96.0%

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + 3-methoxy-2-(trimethylsilyl)phenyl-trifluoromethanesulfonate (217813-03-1) → 3-methoxyphenyl 4-nitrophenyl ether (22479-76-1)

Guidance literature:

With cesium fluoride; In acetonitrile; at 20 ℃; for 24h;

DOI:10.1021/ol0361406

Reference yield: 80.0%

O-methylresorcine (150-19-6) + 4-Fluoronitrobenzene (350-46-9,178603-76-4) → 3-methoxyphenyl 4-nitrophenyl ether (22479-76-1)

Guidance literature:

With potassium fluoride on basic alumina; 18-crown-6 ether; In acetonitrile; for 6h; Heating;

DOI:10.1021/jo980800g

Reference yield:

potassium 3-methoxyphenolate (52688-74-1) + para-nitrophenyl bromide (586-78-7) → 3-methoxyphenyl 4-nitrophenyl ether (22479-76-1)

Guidance literature:

copper;

DOI:10.1021/jo00827a004

upstream raw materials:

3-(4-Nitrophenoxy)phenol

dimethyl sulfate

potassium 3-methoxyphenolate

para-nitrophenyl bromide

Downstream raw materials:

4-(3-methoxyphenoxy)aniline

3-(4-Nitrophenoxy)phenol