2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol

Base Information

• Chemical Name: 2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol
• CAS No.: 194923-89-2
• Molecular Formula: C13H20N2O6
• Molecular Weight: 300.312
• DSSTox Substance ID: DTXSID90571537
• Nikkaji Number: J1.056.364J
• Wikidata: Q82459637
• Mol file: 194923-89-2.mol

Synonyms:194923-89-2;2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol;DTXSID90571537;2-(2-{2-[2-(Methylamino)-5-nitrophenoxy]ethoxy}ethoxy)ethan-1-ol

Chemical Property of 2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 300.13213636
• Heavy Atom Count: 21
• Complexity: 286

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1=C(C=C(C=C1)[N+](=O)[O-])OCCOCCOCCO

Technology Process of 2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol

There total 1 articles about 2-(2-(2-(2-(Methylamino)-5-nitrophenoxy)ethoxy)ethoxy)ethanol 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: 99.0%

2-nitro-6,7,9,10,12,13-hexahydro-5,8,11,14-tetraoxabenzocyclododecene (78554-67-3) + methylamine (74-89-5) → 2-{2-[2-(2-Methylamino-5-nitro-phenoxy)-ethoxy]-ethoxy}-ethanol (194923-89-2)

Guidance literature:

In ethanol; at 100 ℃; for 48h;

Reference yield: 93.0%

2-{2-[2-(2-Methylamino-5-nitro-phenoxy)-ethoxy]-ethoxy}-ethanol (194923-89-2) → (2-{2-[2-(2-chloro-ethoxy)-ethoxy]-ethoxy}-4-nitro-phenyl)-methyl-amine (511538-49-1)

Guidance literature:

With pyridine; sulfuryl dichloride; In chloroform; for 10h; Heating;

Reference yield:

2-{2-[2-(2-Methylamino-5-nitro-phenoxy)-ethoxy]-ethoxy}-ethanol (194923-89-2) → (2-{2-[2-(2-iodo-ethoxy)-ethoxy]-ethoxy}-4-nitro-phenyl)-methyl-amine (511538-52-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 93 percent / SO₂Cl; pyridine / CHCl₃ / 10 h / Heating

2: 98 percent / NaI / acetone / 100 h / Heating

With pyridine; sulfuryl dichloride; sodium iodide; In chloroform; acetone;

upstream raw materials:

2-nitro-6,7,9,10,12,13-hexahydro-5,8,11,14-tetraoxabenzocyclododecene

methylamine

Downstream raw materials:

(2-{2-[2-(2-chloro-ethoxy)-ethoxy]-ethoxy}-4-nitro-phenyl)-methyl-amine

(2-{2-[2-(2-iodo-ethoxy)-ethoxy]-ethoxy}-4-nitro-phenyl)-methyl-amine