4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

Base Information

• Chemical Name: 4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol
• CAS No.: 88205-07-6
• Molecular Formula: C17H21 N O3
• Molecular Weight: 287.359
• DSSTox Substance ID: DTXSID40441190
• Nikkaji Number: J767.791J
• Mol file: 88205-07-6.mol

Synonyms:4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol;88205-07-6;4-[2-(3,4-Dimethoxybenzylamino)ethyl]phenol;SCHEMBL5069115;DTXSID40441190;AKOS010486779;Z792131250

Chemical Property of 4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 287.15214353
• Heavy Atom Count: 21
• Complexity: 279

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)CNCCC2=CC=C(C=C2)O)OC

Technology Process of 4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

There total 7 articles about 4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol 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: 100.0%

4-(2-veratrylidenamino-ethyl)-phenol → 4-[2-(3,4-dimethoxy-benzylamino)ethyl]phenol (88205-07-6)

Guidance literature:

With hydrogen; palladium on activated charcoal; In tetrahydrofuran; at 25 ℃; for 1.16667h; under 15001.2 Torr;

DOI:10.1039/b504854k

Reference yield:

tyrosamine (51-67-2) + 3,4-dimethoxy-benzaldehyde (120-14-9) → 4-[2-(3,4-dimethoxy-benzylamino)ethyl]phenol (88205-07-6)

Guidance literature:

tyrosamine; 3,4-dimethoxy-benzaldehyde; In methanol; at 20 ℃; for 6h;

With sodium tetrahydroborate; In methanol; at 20 ℃; for 4h; Further stages.;

DOI:10.1016/j.tet.2004.03.087

Reference yield:

tyrosamine (51-67-2) → 4-[2-(3,4-dimethoxy-benzylamino)ethyl]phenol (88205-07-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 3 Angstroem molecular sieves

2: 100 percent / H₂ / Pd/C / tetrahydrofuran / 1.17 h / 25 °C / 15001.2 Torr

With 3 A molecular sieve; hydrogen; palladium on activated charcoal; In tetrahydrofuran;

DOI:10.1039/b504854k

upstream raw materials:

tyrosamine

3,4-dimethoxy-benzaldehyde

(3,4-dimethoxyphenyl)methanol

Downstream raw materials:

N-(3,4-dimethoxybenzyl)-N-(4-hydroxyphenethyl)pentafluorobenzamide

ethyl 1-(3,4-dimethoxyphenyl)-4-(4-hydroxyphenyl)-2-azabutane-2-carboxylate

belladine

N-formyl-N-3',4'-dimethoxyphenylmethyl-[2-(4-hydroxyphenyl)]ethylamine