N,N-Diethyl-2-(hydroxymethyl)benzamide

Base Information

• Chemical Name: N,N-Diethyl-2-(hydroxymethyl)benzamide
• CAS No.: 103258-38-4
• Molecular Formula: C12H17NO2
• Molecular Weight: 207.272
• DSSTox Substance ID: DTXSID40546038
• Wikidata: Q82423736
• Mol file: 103258-38-4.mol

Synonyms:103258-38-4;N,N-Diethyl-2-(hydroxymethyl)benzamide;SCHEMBL1097237;DTXSID40546038;LKTLWIYQSSOUBO-UHFFFAOYSA-N;N,N-diethyl-2-hydroxymethyl-benzamide

Chemical Property of N,N-Diethyl-2-(hydroxymethyl)benzamide

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 207.125928785
• Heavy Atom Count: 15
• Complexity: 202

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C(=O)C1=CC=CC=C1CO

Technology Process of N,N-Diethyl-2-(hydroxymethyl)benzamide

There total 11 articles about N,N-Diethyl-2-(hydroxymethyl)benzamide 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: 88.0%

benzofuran-2(3H)-one (553-86-6) + diethylamine (109-89-7) → N,N-diethyl-2-(hydroxymethyl)benzamide (103258-38-4)

Guidance literature:

In acetonitrile; at 30 ℃; for 168h; under 6750540 Torr;

DOI:10.1246/bcsj.62.3138

Reference yield: 88.0%

2-benzofuran-1(3H)-one (87-41-2) + diethylamine (109-89-7) → N,N-diethyl-2-(hydroxymethyl)benzamide (103258-38-4)

Guidance literature:

diethylamine; With aluminum (III) chloride; In 1,2-dichloro-ethane; at 20 ℃; for 0.5h;

2-benzofuran-1(3H)-one; In 1,2-dichloro-ethane; at 20 ℃; for 0.833333h;

DOI:10.1039/c3ob40198g

Reference yield: 62.0%

2-benzofuran-1(3H)-one (87-41-2) + diethyl amine hydrochloride (660-68-4) → N,N-diethyl-2-(hydroxymethyl)benzamide (103258-38-4)

Guidance literature:

diethyl amine hydrochloride; With trimethylaluminum; In hexane; dichloromethane; at 20 ℃; for 0.25h;

2-benzofuran-1(3H)-one; In hexane; dichloromethane; at 25 - 41 ℃; Further stages.;

DOI:10.1021/jm0009742

upstream raw materials:

2-benzofuran-1(3H)-one

diethylamine

N,N-diethyl-ortho-toluamide

N-(Bis-trimethylsilanyl-methyl)-N',N'-diethyl-N-methyl-phthalamide

Downstream raw materials:

N,N-diethyl-2-(bromomethyl)benzamide

N,N-diethyl-o-(3-methyl-2-butenyloxymethyl)benzamide

N,N-diethyl-o-allyloxymethylbenzamide

2-chloromethyl-N,N-diethylbenzamide