N,N-dibutyl-3-methoxyaniline

Base Information

• Chemical Name: N,N-dibutyl-3-methoxyaniline
• CAS No.: 34874-62-9
• Molecular Formula: C₁₅H₂₅NO
• Molecular Weight: 235.37
• European Community (EC) Number: 661-173-1
• DSSTox Substance ID: DTXSID901301628
• Nikkaji Number: J1.653.324F
• Mol file: 34874-62-9.mol

Synonyms:N,N-dibutyl-3-methoxyaniline;Dibutyl(3-methoxyphenyl)amine;SCHEMBL8664850;N,N-Dibutyl-3-methoxybenzenamine;BHRRIXUIPSCYJA-UHFFFAOYSA-N;DTXSID901301628;AKOS024324694;34874-62-9

Chemical Property of N,N-dibutyl-3-methoxyaniline

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 235.193614421
• Heavy Atom Count: 17
• Complexity: 176

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCN(CCCC)C1=CC(=CC=C1)OC

Technology Process of N,N-dibutyl-3-methoxyaniline

There total 8 articles about N,N-dibutyl-3-methoxyaniline 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: 96.9%

3-methoxyphenyl bromide (2398-37-0) + dibutylamine (111-92-2) → N-(3-methoxyphenyl)-di-n-butylamine (34874-62-9)

Guidance literature:

With palladium diacetate; sodium t-butanolate; tri tert-butylphosphoniumtetrafluoroborate; In toluene; for 5h; Reflux; Inert atmosphere;

DOI:10.1002/chem.201705140

Reference yield: 48.7%

3-(N,N-dibutylamino)phenol (43141-69-1) + methyl iodide (74-88-4) → N-(3-methoxyphenyl)-di-n-butylamine (34874-62-9)

Guidance literature:

With potassium carbonate; In 1-methyl-pyrrolidin-2-one; at 60 ℃; for 6h;

Reference yield:

1-iodo-butane (542-69-8) + m-Anisidine (536-90-3,918666-97-4) → N-(3-methoxyphenyl)-di-n-butylamine (34874-62-9)

Guidance literature:

With potassium carbonate; In acetonitrile; for 18h; Reflux;

DOI:10.3987/COM-16-S(S)65

upstream raw materials:

3-methoxyphenyl bromide

dibutylamine

2-Chloroanisole

1-bromo-4-methoxy-benzene

Downstream raw materials:

4-N,N-di-n-butylamino-2-methoxybenzaldehyde

(Z)-2-Cyano-3-(4-dibutylamino-2-methoxy-phenyl)-acrylamide

C₁₇H₂₈N₄OS

5-[1-(4-Dibutylamino-2-methoxy-phenyl)-meth-(Z)-ylidene]-imidazolidine-2,4-dione