N,N-Dimethyl beta-methoxy beta-phenylethylamine

Base Information

• Chemical Name: N,N-Dimethyl beta-methoxy beta-phenylethylamine
• CAS No.: 6721-66-0
• Molecular Formula: C₁₁H₁₇NO
• Molecular Weight: 179.262
• Hs Code.: 2922199090
• DSSTox Substance ID: DTXSID10986321
• Nikkaji Number: J34.546F
• Mol file: 6721-66-0.mol

Synonyms:6721-66-0;N,N-Dimethyl beta-methoxy beta-phenylethylamine;BRN 2804147;N,N-Dimethyl-beta-methoxyphenethylamine;PHENETHYLAMINE, N,N-DIMETHYL-beta-METHOXY-;1-13-00-00240 (Beilstein Handbook Reference);SCHEMBL9493145;DTXSID10986321;N,N-Dimethyl-beta-methoxybenzeneethanamine;LS-103382;Phenethylamine, .beta.-methoxy-N,N-dimethyl-;2-Methoxy-N,N-dimethyl-2-phenylethan-1-amine;Benzeneethanamine, .beta.-methoxy-N,N-dimethyl-

Chemical Property of N,N-Dimethyl beta-methoxy beta-phenylethylamine

Chemical Property:

• Vapor Pressure: 0.04mmHg at 25°C
• Melting Point: 10 °C
• Boiling Point: 239.5°Cat760mmHg
• PKA: 8.59±0.28(Predicted)
• Flash Point: 69.6°C
• PSA: 12.47000
• Density: 0.963g/cm³
• LogP: 1.93570
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 179.131014166
• Heavy Atom Count: 13
• Complexity: 130

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C)CC(C1=CC=CC=C1)OC

Technology Process of N,N-Dimethyl beta-methoxy beta-phenylethylamine

There total 4 articles about N,N-Dimethyl beta-methoxy beta-phenylethylamine 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-(N,N-Dimethylamino)-1-phenylethanol Hydrochloride (1797-76-8,939-44-6) → (β-methoxy-phenethyl)-dimethyl-amine (6721-66-0)

Guidance literature:

Multi-step reaction with 2 steps

1: SOCl₂ / CHCl₃

2: methanol / Heating

With thionyl chloride; In methanol; chloroform;

Reference yield:

(β-chloro-phenethyl)-dimethyl-amine (6407-17-6) + sodium methylate (124-41-4) → (β-methoxy-phenethyl)-dimethyl-amine (6721-66-0)

Guidance literature:

In methanol; Heating;

Reference yield:

2-methoxy-2-phenylethyl iodide (13684-98-5) + dimethyl amine (124-40-3) → (β-methoxy-phenethyl)-dimethyl-amine (6721-66-0)

Guidance literature:

With benzene;

upstream raw materials:

2-methoxy-2-phenylethyl iodide

dimethyl amine

(β-chloro-phenethyl)-dimethyl-amine

sodium methylate

Downstream raw materials:

(β-methoxy-phenethyl)-trimethyl-ammonium; iodide

Refernces