1,2-Bis(3-nitrophenoxy)ethane

Base Information

• Chemical Name: 1,2-Bis(3-nitrophenoxy)ethane
• CAS No.: 25986-11-2
• Molecular Formula: C14H12 N2 O6
• Molecular Weight: 304.259
• European Community (EC) Number: 653-259-2
• NSC Number: 113231
• DSSTox Substance ID: DTXSID80297032
• Nikkaji Number: J1.878.885C
• Wikidata: Q82037944
• Mol file: 25986-11-2.mol

Synonyms:1,2-Bis(3-nitrophenoxy)ethane;25986-11-2;1-nitro-3-[2-(3-nitrophenoxy)ethoxy]benzene;1,1'-[ethane-1,2-diylbis(oxy)]bis(3-nitrobenzene);NSC113231;1,2-bis(m-nitrophenoxy)ethane;SCHEMBL15498199;DTXSID80297032;AKOS008648310;NSC-113231

Chemical Property of 1,2-Bis(3-nitrophenoxy)ethane

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 304.06953611
• Heavy Atom Count: 22
• Complexity: 345

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1,2-Bis(3-nitrophenoxy)ethane

There total 3 articles about 1,2-Bis(3-nitrophenoxy)ethane 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: 80.0%

meta-nitrophenol (554-84-7) + ethylene dibromide (106-93-4) → 1,2-bis-(3-nitro-phenoxy)-ethane (25986-11-2)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 6h;

DOI:10.1021/jm401252e

Reference yield: 30.0%

sodium 3-nitrophenoxide (3019-85-0) + ethylene dibromide (106-93-4) → 1,2-bis-(3-nitro-phenoxy)-ethane (25986-11-2)

Guidance literature:

In N,N-dimethyl-formamide; for 2h; Heating;

Reference yield:

meta-nitrophenol (554-84-7) → 1,2-bis-(3-nitro-phenoxy)-ethane (25986-11-2)

Guidance literature:

Multi-step reaction with 2 steps

1: NaOH / ethanol

2: 30 percent / dimethylformamide / 2 h / Heating

With sodium hydroxide; In ethanol; N,N-dimethyl-formamide;

upstream raw materials:

sodium 3-nitrophenoxide

ethylene dibromide

meta-nitrophenol

Downstream raw materials:

[(3-{2-[3-(Bis-ethoxycarbonylmethyl-amino)-phenoxy]-ethoxy}-phenyl)-ethoxycarbonylmethyl-amino]-acetic acid ethyl ester

1,2-bis(m-aminophenoxy)ethane