N-(2,6-dimethylphenyl)butanamide

Base Information

• Chemical Name: N-(2,6-dimethylphenyl)butanamide
• CAS No.: 33098-75-8
• Molecular Formula: C₁₂H₁₇NO
• Molecular Weight: 191.273
• DSSTox Substance ID: DTXSID60186758
• Nikkaji Number: J55.499E
• Wikidata: Q83058139
• Mol file: 33098-75-8.mol

Synonyms:N-(2,6-dimethylphenyl)butanamide;n-BUTYRANILIDE, 2,6-DIMETHYL-;33098-75-8;2,6-Dimethyl-n-butyranilide;BRN 2643549;2',6'-Butyroxylidide;N-butyryl-2,6-dimethylaniline;SCHEMBL7227453;DTXSID60186758;AKOS003845856;Butanamide, N-(2,6-dimethylphenyl)-;LS-47764

Chemical Property of N-(2,6-dimethylphenyl)butanamide

Chemical Property:

• Vapor Pressure: 0.000488mmHg at 25°C
• Boiling Point: 313.7°Cat760mmHg
• Flash Point: 186.1°C
• PSA: 32.59000
• Density: 1.016g/cm³
• LogP: 3.69150
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 191.131014166
• Heavy Atom Count: 14
• Complexity: 181

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)NC1=C(C=CC=C1C)C

Technology Process of N-(2,6-dimethylphenyl)butanamide

There total 2 articles about N-(2,6-dimethylphenyl)butanamide 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:

butyryl chloride (141-75-3) + 2,6-dimethylaniline (87-62-7) → Buttersaeure-<2,6-dimethyl-anilid> (33098-75-8)

Guidance literature:

2,6-dimethylaniline; With triethylamine; In tetrahydrofuran; at 25 ℃; for 0.166667h;

butyryl chloride; In tetrahydrofuran; at 25 ℃; for 3h; Sealed tube;

DOI:10.1039/d0cc06777f

Reference yield:

→ Buttersaeure-<2,6-dimethyl-anilid> (33098-75-8)

Guidance literature:

2,6-Dimethyl-anilin, Buttersaeurechlorid;

upstream raw materials:

butyryl chloride

2,6-dimethylaniline

Refernces