5-Nitroheptan-2-one

Base Information

Chemical Name:5-Nitroheptan-2-one
CAS No.:42397-25-1
Molecular Formula:C7H13NO3
Molecular Weight:159.185
Hs Code.:
DSSTox Substance ID:DTXSID20440646
Nikkaji Number:J738.250B

Synonyms:5-nitro-2-heptanone;5-nitroheptan-2-one;5-nitro-heptan-2-one;42397-25-1;5-nitroheptane-2-on;SCHEMBL18471488;DTXSID20440646

Suppliers and Price of 5-Nitroheptan-2-one

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 5-Nitroheptan-2-one

Chemical Property:

XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:159.08954328
Heavy Atom Count:11
Complexity:150

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(CCC(=O)C)[N+](=O)[O-]

Technology Process of 5-Nitroheptan-2-one

There total 1 articles about 5-Nitroheptan-2-one 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:

: 78-94-4,25038-87-3
methyl vinyl ketone

: 108-03-2
1-Nitropropane

: 42397-25-1
5-nitroheptan-2-one

: 100401-24-9
(+/-)-1-(5-ethyl-2-hydroxy-2-methyl-5-nitrocyclohexyl)-1-ethanone

Guidance literature:: With poly(propyleneimine) 5th generation dendrimer functionalized with C₁₆ alkyl chain; In toluene; at 70 ℃; for 48h; Inert atmosphere;
DOI:10.1246/cl.2012.801

Reference yield: 78.0%

: 42397-25-1
5-nitroheptan-2-one

: 61266-34-0
1-(3-bromoprop-1-yn-1-yl)-4-nitrobenzene

: C₁₆H₁₈N₂O₅

Guidance literature:: 5-nitroheptan-2-one; With N,N-diisopropyl-1,2-ethanediamine; potassium tert-butylate; copper(I) bromide; In 1,4-dioxane; at 20 ℃; for 0.5h; Schlenk technique; Inert atmosphere;

1-(3-bromoprop-1-yn-1-yl)-4-nitrobenzene; In 1,4-dioxane; at 20 ℃; for 4h; Schlenk technique; Inert atmosphere;
DOI:10.1021/acs.orglett.0c03061