Acetamide, N-[4-(3-oxopropyl)phenyl]-

Base Information

Chemical Name:Acetamide, N-[4-(3-oxopropyl)phenyl]-
CAS No.:169054-06-2
Molecular Formula:C11H13 N O2
Molecular Weight:191.23
Hs Code.:
DSSTox Substance ID:DTXSID70432814
Nikkaji Number:J694.571F
Wikidata:Q82246926
Mol file:169054-06-2.mol

Synonyms:169054-06-2;Acetamide, N-[4-(3-oxopropyl)phenyl]-;N-[4-(3-oxopropyl)phenyl]acetamide;3-(4-acetamidophenyl)propanal;N-[4-(3-OXO-PROPYL)-PHENYL]-ACETAMIDE;Acetamide,N-[4-(3-oxopropyl)phenyl]-;4'-(3-Oxopropyl)acetoanilide;SCHEMBL2833160;DTXSID70432814;PCWAUWKOMNLWIJ-UHFFFAOYSA-N;3-(4'-Acetamidophenyl)-1-propanal;AKOS006229942;EN300-1833983

Suppliers and Price of Acetamide, N-[4-(3-oxopropyl)phenyl]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
N-[4-(3-OXO-PROPYL)PHENYL]ACETAMIDE 95.00%
5MG
$ 500.86

Total 3 raw suppliers

Chemical Property of Acetamide, N-[4-(3-oxopropyl)phenyl]-

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.562
Boiling Point:382.489°C at 760 mmHg
PKA:15.04±0.70(Predicted)
Flash Point:165.453°C
PSA：49.66000
Density:1.13g/cm³
LogP:2.42600
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:191.094628657
Heavy Atom Count:14
Complexity:196

Purity/Quality:

97% ^*data from raw suppliers

N-[4-(3-OXO-PROPYL)PHENYL]ACETAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)NC1=CC=C(C=C1)CCC=O

Technology Process of Acetamide, N-[4-(3-oxopropyl)phenyl]-

There total 4 articles about Acetamide, N-[4-(3-oxopropyl)phenyl]- 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: 90.0%

: 221029-58-9,857951-87-2
(E)-N-(4-(3-oxoprop-1-en-1-yl)phenyl)acetamide

: 169054-06-2
3-(4-acetylaminophenyl)propanal

Guidance literature:: With sodium hydrogencarbonate; rac-nornicotine; In phosphate buffer; dimethyl sulfoxide; at 32 ℃; for 6h; pH=7.0;
DOI:10.1039/b713273e

Reference yield: 51.0%

: 622-50-4
4-Acetamido-1-iodobenzene

: 107-18-6
allyl alcohol

: 169054-06-2
3-(4-acetylaminophenyl)propanal

Guidance literature:: With 1-methyl-pyrrolidin-2-one; sodium hydrogencarbonate; palladium dichloride; at 150 ℃; for 4h;
DOI:10.1021/jo00126a057

Reference yield:

: 540-37-4
p-aminoiodobenzene

: 169054-06-2
3-(4-acetylaminophenyl)propanal

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent / triethylamine / CH₂Cl₂ / 2 h / Ambient temperature

2: 1.) tetrabutylammonium chloride, sodium bicarbonate, 2.) PdCl₂ / 1.) DMF, 10 min, 2.) DMF, RT, 36 h

With tetrabutyl-ammonium chloride; sodium hydrogencarbonate; triethylamine; palladium dichloride; In dichloromethane;
DOI:10.1021/ja9620797