Acetamide, N-3-dibenzofuranyl-

Base Information

• Chemical Name: Acetamide, N-3-dibenzofuranyl-
• CAS No.: 5834-25-3
• Molecular Formula: C14H11NO2
• Molecular Weight: 225.26
• European Community (EC) Number: 688-701-3
• DSSTox Substance ID: DTXSID40207071
• Nikkaji Number: J33.414F
• Wikidata: Q83080960
• ChEMBL ID: CHEMBL63423
• Mol file: 5834-25-3.mol

Synonyms:5834-25-3;3-Acetamidodibenzofuran;N-(dibenzo[b,d]furan-3-yl)acetamide;ACETAMIDE, N-3-DIBENZOFURANYL-;N-3-Dibenzofuranylacetamide;3-Acetamidodibenzfurane;3-Acetylaminodibenzofuran;3-Dibenzofuranylacetamide;Dibenzofuran, 3-acetamido-;N-dibenzofuran-3-ylacetamide;BRN 0384210;N-(Dibenzofuran-3-yl)acetamide;CHEMBL63423;n-{8-oxatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),3,5,10,12-hexaen-5-yl}acetamide;N-Dibenzofuran-3-yl-acetamide;Oprea1_750839;Oprea1_859127;2-ACETAMIDODIBENZOFURAN;F3229-0063;SCHEMBL14295750;DTXSID40207071;LEHHDJYYMLPGOR-UHFFFAOYSA-N;BDBM50038935;STK729521;AKOS000629548;N-Dibenzo[b,d]furan-3-ylacetamide #;LS-8801;CS-0240144;EN300-225768;SR-01000400506;SR-01000400506-1;Z274644156

Chemical Property of Acetamide, N-3-dibenzofuranyl-

Chemical Property:

• Vapor Pressure: 6.45E-09mmHg at 25°C
• Refractive Index: 1.5780 (estimate)
• Boiling Point: 467.5°Cat760mmHg
• Flash Point: 236.6°C
• PSA: 45.73000
• Density: 1.297g/cm³
• LogP: 4.19390
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 225.078978594
• Heavy Atom Count: 17
• Complexity: 305

Purity/Quality:

99% ^*data from raw suppliers

N-{8-oxatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),3,5,10,12-hexaen-5-yl}acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3O2

Technology Process of Acetamide, N-3-dibenzofuranyl-

There total 5 articles about Acetamide, N-3-dibenzofuranyl- 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: 20.0%

3-aminodibenzofuran (4106-66-5) + acetyl chloride (75-36-5) → N-{8-oxatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-5-yl}acetamide (5834-25-3)

Guidance literature:

With sodium carbonate; In tetrahydrofuran; at 20 ℃; for 1h; Inert atmosphere;

Reference yield:

3-aminodibenzofuran (4106-66-5) + acetic anhydride (108-24-7) → N-{8-oxatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-5-yl}acetamide (5834-25-3)

Guidance literature:

With ethanol;

Reference yield:

3-bromo-7-nitro-dibenzofuran (25074-60-6) → N-{8-oxatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-5-yl}acetamide (5834-25-3)

Guidance literature:

Multi-step reaction with 2 steps

1: palladium; ethanol / Hydrogenation

2: aqueous acetic acid

With ethanol; palladium; acetic acid;

DOI:10.1021/ja01265a080

upstream raw materials:

3-aminodibenzofuran

acetic anhydride

acetic acid

3-bromo-7-nitro-dibenzofuran

Downstream raw materials:

2,3-diaminodibenzofuran

Refernces

• 1、 -. "AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME". Page/Page column 90. . Retrieved 2012/12/13.