2-(Methyl(4-nitrophenyl)amino)ethanol

Base Information

• Chemical Name: 2-(Methyl(4-nitrophenyl)amino)ethanol
• CAS No.: 18226-16-9
• Molecular Formula: C9H12N2O3
• Molecular Weight: 196.206
• Hs Code.: 2922199090
• European Community (EC) Number: 847-043-9
• DSSTox Substance ID: DTXSID30404118
• Nikkaji Number: J713.122D
• Wikidata: Q82208122
• Mol file: 18226-16-9.mol

Synonyms:18226-16-9;2-(Methyl(4-nitrophenyl)amino)ethanol;2-(N-methyl-4-nitroanilino)ethanol;2-[methyl(4-nitrophenyl)amino]ethan-1-ol;2-(methyl-4-nitroanilino)ethanol;2-(methyl(4-nitrophenyl)amino)ethan-1-ol;Ethanol, 2-[methyl(4-nitrophenyl)amino]-;2-[methyl-(4-nitrophenyl)amino]ethanol;SCHEMBL1729465;DTXSID30404118;BWUZCAZXFREZFN-UHFFFAOYSA-N;9H-Fluorene, 9-chloro-9-phenyl-;AKOS007995500;CS-0216717;FT-0746429;2-[N-(p-nitrophenyl)-N-methylamino]-ethanol;EN300-55698;A848211;Z31205911

Chemical Property of 2-(Methyl(4-nitrophenyl)amino)ethanol

Chemical Property:

• PSA: 69.29000
• LogP: 1.54650
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 196.08479225
• Heavy Atom Count: 14
• Complexity: 185

Purity/Quality:

97% ^*data from raw suppliers

2-[methyl(4-nitrophenyl)amino]ethan-1-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-(Methyl(4-nitrophenyl)amino)ethanol

There total 8 articles about 2-(Methyl(4-nitrophenyl)amino)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: 76.4%

(2-hydroxyethyl)(methyl)amine (109-83-1) + para-nitrophenyl bromide (586-78-7) → N-(2-hydroxyethyl)-N-methyl-4-nitroaniline (18226-16-9)

Guidance literature:

With copper(l) iodide; potassium carbonate; potassium iodide; In N,N-dimethyl acetamide; at 120 ℃; Inert atmosphere;

Reference yield: 76.0%

(2-hydroxyethyl)(methyl)amine (109-83-1) + 4-Fluoronitrobenzene (350-46-9,178603-76-4) → N-(2-hydroxyethyl)-N-methyl-4-nitroaniline (18226-16-9)

Guidance literature:

With potassium carbonate; In dimethyl sulfoxide; at 45 ℃; for 19h;

DOI:10.1002/chem.201403917

Reference yield:

4-Nitrobenzenesulfonyl chloride (98-74-8) → N-(2-hydroxyethyl)-N-methyl-4-nitroaniline (18226-16-9)

Guidance literature:

Multi-step reaction with 2 steps

2: aq. NaOH / acetonitrile / 61 °C

With sodium hydroxide; In acetonitrile;

DOI:10.1039/P29760001741

upstream raw materials:

N-methyl-2-(p-nitrophenoxy)ethylamine

N-(2-hydroxyethyl)-N-methyl-4-nitro-benzenesulfonamide

(2-hydroxyethyl)(methyl)amine

4-Fluoronitrobenzene

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