2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine

Base Information

• Chemical Name: 2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine
• CAS No.: 203394-30-3
• Molecular Formula: C17H18N2O
• Molecular Weight: 266.34
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20389541
• Mol file: 203394-30-3.mol

Synonyms:203394-30-3;2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine;2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethanamine;2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethan-1-amine;[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]amine;MFCD02731132;BAS 01057227;Oprea1_359818;Oprea1_648254;SCHEMBL7006159;DTXSID20389541;HMS1693K02;BBL010489;STK801625;AKOS000267385;AKOS016038991;NCGC00329208-01;NS-04209;BB 0218708;CS-0307838;EN300-08545;AB01322473-02;SR-01000311370;J-505357;SR-01000311370-1;Z56942080;2-(1H-indol-3-yl)-2-(4-methoxyphenyl)-1-ethanamine

Chemical Property of 2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine

Chemical Property:

• PSA: 51.04000
• LogP: 3.96740
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 266.141913202
• Heavy Atom Count: 20
• Complexity: 301

Purity/Quality:

99% ^*data from raw suppliers

2-(1H-Indol-3-yl)-2-(4-methoxyphenyl)ethanamine 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(CN)C2=CNC3=CC=CC=C32

Technology Process of 2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine

There total 10 articles about 2-(1H-Indol-3-yl)-2-(4-methoxy-phenyl)-ethylamine 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: 77.0%

3-[1-(4-methoxyphenyl)-2-nitroethyl]-1H-indole (33723-33-0) → 2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethanamine (203394-30-3)

Guidance literature:

With hydrogen; nickel; In ethanol;

DOI:10.1080/00397910008087346

Reference yield: 42.0%

3-[2-fluoro-1-(4-methoxyphenyl)-2-nitroethyl]-1H-indole → 2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethanamine (203394-30-3)

Guidance literature:

With methanol; sodium tetrahydroborate; nickel(II) chloride hexahydrate; at 0 - 20 ℃;

DOI:10.1002/ejoc.201800385

Reference yield:

indole (120-72-9) → 2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethanamine (203394-30-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 87 percent / butan-1-ol / 48 h / Heating

2: 77 percent / H₂ / Ra/Ni / ethanol

With hydrogen; nickel; In ethanol; butan-1-ol; 1: Addition / 2: Reduction;

DOI:10.1080/00397910008087346

upstream raw materials:

3-[1-(4-methoxyphenyl)-2-nitroethyl]-1H-indole

indole

(E)-1-methoxy-4-(2-nitrovinyl)benzene

1-[(Z)-2-fluoro-2-nitroethenyl]-4-(methyloxy)benzene