1-(4-Nitrophenyl)-1-butanone

Base Information

Chemical Name:1-(4-Nitrophenyl)-1-butanone
CAS No.:3769-94-6
Molecular Formula:C10H11NO3
Molecular Weight:193.202
Hs Code.:
DSSTox Substance ID:DTXSID70191131
Wikidata:Q83063621
Mol file:3769-94-6.mol

Synonyms:1-(4-Nitrophenyl)-1-butanone;3769-94-6;Butyrophenone, 4'-nitro-;SCHEMBL9439988;DTXSID70191131

Suppliers and Price of 1-(4-Nitrophenyl)-1-butanone

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

Total 1 raw suppliers

Chemical Property of 1-(4-Nitrophenyl)-1-butanone

Chemical Property:

Vapor Pressure:0.000905mmHg at 25°C
Melting Point:66 °C
Boiling Point:303.9°C at 760 mmHg
Flash Point:137°C
PSA：62.89000
Density:1.165g/cm³
LogP:3.10080
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:193.07389321
Heavy Atom Count:14
Complexity:214

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Technology Process of 1-(4-Nitrophenyl)-1-butanone

There total 14 articles about 1-(4-Nitrophenyl)-1-butanone 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: 96.0%

: 157561-07-4
4-nitrophenyl butanol

: 3769-94-6
1-(4-nitrophenyl)butan-1-one

Guidance literature:: With oxygen; isobutyraldehyde; In 1,2-dichloro-ethane; at 70 ℃; for 7h;

Reference yield: 90.0%

: 111922-88-4
2-[1-Morpholin-4-yl-meth-(E)-ylidene]-1-(4-nitro-phenyl)-butan-1-one

: 3769-94-6
1-(4-nitrophenyl)butan-1-one

Guidance literature:: With hydrogenchloride; In 1,4-dioxane; for 4h; Heating;

Reference yield: 88.0%

: 636-98-6
p-nitrobenzene iodide

: 18257-69-7
n-C₃H₇HgI

: 3769-94-6
1-(4-nitrophenyl)butan-1-one

Guidance literature:: With carbon monoxide; tetra-(n-butyl)ammonium iodide; dichloro bis(acetonitrile) palladium(II); In N,N,N,N,N,N-hexamethylphosphoric triamide; carbonylation with 4 eq. Bu4NI, 1 atm. CO, 20 °C, 3h; detn. by UV;
DOI:10.1016/0022-328X(89)87037-8