Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]-

Base Information

• Chemical Name: Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]-
• CAS No.: 112757-08-1
• Molecular Formula: C₁₆H₁₉NO
• Molecular Weight: 241.333
• ChEMBL ID: CHEMBL1192719
• DSSTox Substance ID: DTXSID00505989
• Wikidata: Q82361503
• Mol file: 112757-08-1.mol

Synonyms:2-(2-Benzylphenoxy)-N-methylethanamine;112757-08-1;Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]-;CHEMBL1192719;SCHEMBL11750789;DTXSID00505989;AKOS011890154;2-(2-Benzylphenoxy)-N-methylethan-1-amine;A1-05622

Chemical Property of Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]-

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 241.146664230
• Heavy Atom Count: 18
• Complexity: 213

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCCOC1=CC=CC=C1CC2=CC=CC=C2

Technology Process of Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]-

There total 4 articles about Ethanamine, N-methyl-2-[2-(phenylmethyl)phenoxy]- 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: 50.0%

1-benzyl-2-(2-chloroethoxy)benzene (408340-95-4) + methylamine (74-89-5) → 2-(2-benzylphenoxy)-N-methylethan-1-amine (112757-08-1)

Guidance literature:

In ethanol; at 130 ℃; for 0.583333h; Microwave irradiation; Inert atmosphere;

DOI:10.1021/acs.jmedchem.6b00981

Reference yield:

o-Benzylphenol (28994-41-4) → 2-(2-benzylphenoxy)-N-methylethan-1-amine (112757-08-1)

Guidance literature:

Multi-step reaction with 2 steps

1: KOH / methanol / 8 h / Heating

2: ethanol; H₂O / 24 h / Ambient temperature

With potassium hydroxide; In methanol; ethanol; water;

DOI:10.1021/jm00134a004

Reference yield:

1-(2-bromoethoxy)-2-benzylbenzene (165683-42-1) + methylamine (74-89-5) → 2-(2-benzylphenoxy)-N-methylethan-1-amine (112757-08-1)

Guidance literature:

With 1,4-dioxane;

DOI:10.1021/ja01169a017

upstream raw materials:

1-(2-bromoethoxy)-2-benzylbenzene

methylamine

o-Benzylphenol

Natrium-(2-benzyl-phenolat)