2-(3-Methoxyphenoxy)ethanamine

Base Information

• Chemical Name: 2-(3-Methoxyphenoxy)ethanamine
• CAS No.: 6487-86-1
• Molecular Formula: C9H13NO2
• Molecular Weight: 167.208
• Hs Code.: 2922190090
• DSSTox Substance ID: DTXSID60383189
• Nikkaji Number: J1.883.941E
• Wikidata: Q82174835
• ChEMBL ID: CHEMBL4521135
• Mol file: 6487-86-1.mol

Synonyms:2-(3-methoxyphenoxy)ethanamine;6487-86-1;2-(3-methoxyphenoxy)ethylamine;Ethanamine, 2-(3-methoxyphenoxy)-;MFCD02598966;[2-(3-methoxyphenoxy)ethyl]amine hydrochloride;AURORA KA-7735;SCHEMBL4542738;CHEMBL4521135;DTXSID60383189;2-(3-methoxyphenoxy)ethan-1-amine;AMY20101;BBL003515;STK520644;AKOS000142232;SS-4020;SY008274;2-(3-methoxyphenoxy)ethanamine, AldrichCPR;BB 0257489;CS-0199196;FT-0671319;EN300-31635;A867803;J-505800

Chemical Property of 2-(3-Methoxyphenoxy)ethanamine

Chemical Property:

• Vapor Pressure: 0.00355mmHg at 25°C
• Boiling Point: 281.5oC at 760 mmHg
• Flash Point: 134.7oC
• PSA: 44.48000
• Density: 1.06g/cm3
• LogP: 1.73300
• Storage Temp.: Refrigerator
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 167.094628657
• Heavy Atom Count: 12
• Complexity: 119

Purity/Quality:

98%min ^*data from raw suppliers

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

Safty Information:

• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC=C1)OCCN
• Uses: 2-(3-Methoxyphenoxy)ethanamine (cas# 6487-86-1) is a compound useful in organic synthesis.

Technology Process of 2-(3-Methoxyphenoxy)ethanamine

There total 5 articles about 2-(3-Methoxyphenoxy)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: 70.0%

2-(3-methoxyphenoxy)acetamide (198905-40-7) → 2-(3-methoxyphenoxy)ethanamine (6487-86-1)

Guidance literature:

With dimethylsulfide borane complex; In tetrahydrofuran; at 90 ℃; for 16h; Inert atmosphere;

DOI:10.1021/jm400766k

Reference yield: 69.0%

2-[2-(3-methoxyphenoxy)ethyl]-1H-isoindole-1,3(2H)-dione (6488-05-7) → 2-(3-methoxyphenoxy)ethanamine (6487-86-1)

Guidance literature:

With hydrazine hydrate; acetic acid; In methanol; for 4h; Reflux;

DOI:10.1016/j.bmc.2010.06.100

Reference yield:

1-(2-bromoethoxy)-3-methoxybenzene (3245-45-2) → 2-(3-methoxyphenoxy)ethanamine (6487-86-1)

Guidance literature:

With ammonia; In methanol; at 105 - 110 ℃;

upstream raw materials:

1-(2-bromoethoxy)-3-methoxybenzene

potassium phtalimide

2-(3-methoxyphenoxy)acetamide

2-[2-(3-methoxyphenoxy)ethyl]-1H-isoindole-1,3(2H)-dione

Downstream raw materials:

C₂₅H₂₇NO₄

N-[2-(3-methoxyphenoxy)ethyl]acetamide

C₂₆H₂₈N₄O₃

2-Isopropyl-5-[2-(3-methoxy-phenoxy)-ethylamino]-2-(3,4,5-trimethoxy-phenyl)-pentanenitrile

Refernces

• 1、 Sniecikowska, Joanna,Gluch-Lutwin, Monika,Bucki, Adam,Wi?ckowska, Anna,Siwek, Agata,Jastrzebska-Wiesek, Magdalena,Partyka, Anna,Wilczyńska, Daria,Pytka, Karolina,Latacz, Gniewomir,Przejczowska-Pomierny, Katarzyna,Wyska, El?bieta,Weso?owska, Anna,Paw?owski, Maciej,Newman-Tancredi, Adrian,Kolaczkowski, Marcin. "Discovery of Novel pERK1/2- or β-Arrestin-Preferring 5-HT1AReceptor-Biased Agonists: Diversified Therapeutic-like versus Side Effect Profile". supporting information. p. 10946 - 10971. Retrieved 2020/11/09.
• 2、 Valhondo, Margarita,Marco, Isabel,Martín-Fontecha, Mar,Vázquez-Villa, Henar,Ramos, José A.,Berkels, Reinhard,Lauterbach, Thomas,Benhamú, Bellinda,López-Rodríguez, María L.. "New serotonin 5-HT1A receptor agonists endowed with antinociceptive activity in vivo". supporting information. p. 7851 - 7861. Retrieved 2013/11/06.