2-(3-Methylphenoxy)ethanamine

Base Information

• Chemical Name: 2-(3-Methylphenoxy)ethanamine
• CAS No.: 6487-99-6
• Molecular Formula: C9H13 N O
• Molecular Weight: 151.208
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID40368934
• Wikidata: Q82155839
• Mol file: 6487-99-6.mol

Synonyms:6487-99-6;2-(3-methylphenoxy)ethylamine;2-(3-methylphenoxy)ethanamine;2-(m-Tolyloxy)ethanamine;Ethanamine, 2-(3-methylphenoxy)-;MFCD02856329;1-(2-aminoethoxy)-3-methylbenzene;SCHEMBL7408051;DTXSID40368934;2-(3-methylphenoxy)-1-ethanamine;2-(3-methylphenoxy)ethan-1-amine;AMY20103;STK523738;AKOS000201020;SB75795;NCGC00329665-01;AS-31742;SY008283;CS-0153213;FT-0683065;EN300-12557;2-(3-methylphenoxy)-1-ethanamine, AldrichCPR;AB01323824-02;A867802

Chemical Property of 2-(3-Methylphenoxy)ethanamine

Chemical Property:

• Vapor Pressure: 0.0155mmHg at 25°C
• Boiling Point: 256.3°C at 760 mmHg
• PKA: 8.60±0.10(Predicted)
• Flash Point: 112.3°C
• PSA: 35.25000
• Density: 1.008g/cm³
• LogP: 2.83480
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 151.099714038
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

97% ^*data from raw suppliers

2-(3-Methylphenoxy)ethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)OCCN

Technology Process of 2-(3-Methylphenoxy)ethanamine

There total 6 articles about 2-(3-Methylphenoxy)ethanamine 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:

2-(2-(m-tolyloxy)ethyl)isoindoline-1,3-dione (6488-03-5) → 2-(m-tolyloxy)ethanamine (6487-99-6)

Guidance literature:

With hydrazine hydrate; In ethanol; at 50 ℃; for 4h;

DOI:10.1021/acsmedchemlett.6b00330

Reference yield:

1-(2-bromoethoxy)-3-methylbenzene (6512-13-6) → 2-(m-tolyloxy)ethanamine (6487-99-6)

Guidance literature:

1-(2-bromoethoxy)-3-methylbenzene; With 18-crown-6 ether; potassium phtalimide; In N,N-dimethyl-formamide; at 50 ℃; for 3h;

With methylamine; In water; at 50 ℃; for 2h;

With sodium hydroxide; In water; at 20 ℃; for 1h;

DOI:10.1021/acs.jmedchem.0c00814

Reference yield:

3-methyl-phenol (108-39-4) → 2-(m-tolyloxy)ethanamine (6487-99-6)

Guidance literature:

Multi-step reaction with 2 steps

1: triphenylphosphine; diethylazodicarboxylate / tetrahydrofuran / 0 - 20 °C / Inert atmosphere

2: hydrazine hydrate / ethanol / 4 h / 50 °C

With hydrazine hydrate; triphenylphosphine; diethylazodicarboxylate; In tetrahydrofuran; ethanol;

DOI:10.1021/acsmedchemlett.6b00330

upstream raw materials:

1-(2-bromoethoxy)-3-methylbenzene

2-(2-(m-tolyloxy)ethyl)isoindoline-1,3-dione

3-methyl-phenol

Downstream raw materials:

2-Isopropyl-5-(2-m-tolyloxy-ethylamino)-2-(3,4,5-trimethoxy-phenyl)-pentanenitrile

C₂₆H₂₈N₄O₂

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