1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone
• CAS No.: 505070-85-9
• Molecular Formula: C12H17NO2
• Molecular Weight: 207.272
• Hs Code.: 2922509090
• DSSTox Substance ID: DTXSID00355729
• Wikidata: Q82134779
• ChEMBL ID: CHEMBL1625686
• Mol file: 505070-85-9.mol

Synonyms:505070-85-9;1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone;1-(3-Dimethylaminomethyl-4-methoxy-phenyl)-ethanone;1-{3-[(dimethylamino)methyl]-4-methoxyphenyl}ethanone;1-[3-[(dimethylamino)methyl]-4-methoxyphenyl]ethanone;1-{3-[(dimethylamino)methyl]-4-methoxyphenyl}ethan-1-one;1-(3-((dimethylamino)methyl)-4-methoxyphenyl)ethan-1-one;SCHEMBL3684732;CHEMBL1625686;DTXSID00355729;JOQIFNHFGHVTIP-UHFFFAOYSA-N;AKOS000117341;SB77561;EN300-09784;Z54847090

Chemical Property of 1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone

Chemical Property:

• PSA: 29.54000
• LogP: 1.95940
• Storage Temp.: 2-8°C
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 207.125928785
• Heavy Atom Count: 15
• Complexity: 216

Purity/Quality:

98% ^*data from raw suppliers

1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone

There total 5 articles about 1-(3-((Dimethylamino)methyl)-4-methoxyphenyl)ethanone 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: 42.0%

-butyl vinyl ether (111-34-2,92680-80-3) + (5-bromo-2-methoxybenzyl)dimethylamine (7078-90-2) → 1-(3-dimethylaminomethyl-4-methoxyphenyl)ethanone (505070-85-9)

Guidance literature:

-butyl vinyl ether; (5-bromo-2-methoxybenzyl)dimethylamine; With palladium diacetate; 1,3-bis-(diphenylphosphino)propane; potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃;

With hydrogenchloride; In N,N-dimethyl-formamide; for 1h;

DOI:10.1021/jm049424k

Reference yield: 42.0%

butyl ethyl ether (628-81-9) + (5-bromo-2-methoxybenzyl)dimethylamine (7078-90-2) → 1-(3-dimethylaminomethyl-4-methoxyphenyl)ethanone (505070-85-9)

Guidance literature:

butyl ethyl ether; (5-bromo-2-methoxybenzyl)dimethylamine; With potassium carbonate; palladium diacetate; 1,3-bis-(diphenylphosphino)propane; In DMF (N,N-dimethyl-formamide); water; at 80 ℃;

With hydrogenchloride; In DMF (N,N-dimethyl-formamide); water; for 1h;

Reference yield:

4-bromo-2-(chloromethyl)-1-methoxybenzene (7017-52-9) → 1-(3-dimethylaminomethyl-4-methoxyphenyl)ethanone (505070-85-9)

Guidance literature:

Multi-step reaction with 2 steps

1.1: 4.0 g / tetrahydrofuran / 18 h / 20 °C

2.1: Pd(OAc)2; 1,3-bis(diphenylphosphino)propane; aq. K₂CO₃ / dimethylformamide / 80 °C

2.2: 42 percent / aq. HCl / dimethylformamide / 1 h

With palladium diacetate; 1,3-bis-(diphenylphosphino)propane; potassium carbonate; In tetrahydrofuran; N,N-dimethyl-formamide;

DOI:10.1021/jm049424k

upstream raw materials:

-butyl vinyl ether

(5-bromo-2-methoxybenzyl)dimethylamine

4-bromo-2-(chloromethyl)-1-methoxybenzene

5-bromo-2-methoxy-benzyl alcohol

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 505070-85-9 1-(3-DIMETHYLAMINOMETHYL-4-METHOXY-PHENYL)-ETHANONE

Send

Send

Metric Ton KG G Pound L ML

Send

Send