2-Hexanone, 5-nitro-4-phenyl-

Base Information

Chemical Name:2-Hexanone, 5-nitro-4-phenyl-
CAS No.:87774-43-4
Molecular Formula:C12H15NO3
Molecular Weight:221.256
Hs Code.:
DSSTox Substance ID:DTXSID80458742
Nikkaji Number:J1.834.722I

Synonyms:2-Hexanone, 5-nitro-4-phenyl-;87774-43-4;4-Phenyl-5-nitro-2-hexanone;DTXSID80458742

Suppliers and Price of 2-Hexanone, 5-nitro-4-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

Total 0 raw suppliers

Chemical Property of 2-Hexanone, 5-nitro-4-phenyl-

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:221.10519334
Heavy Atom Count:16
Complexity:254

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-Hexanone, 5-nitro-4-phenyl-

There total 3 articles about 2-Hexanone, 5-nitro-4-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: 98.0%

: 79-24-3
Nitroethane

: 1896-62-4
(E)-benzalacetone

: 87774-43-4
(+/-)-5-nitro-4-phenylhexan-2-one

Guidance literature:: With 2-tert-butylimino-2-diethylamino-1,3-dimethylperhydro-1,3, 2-diazaphosphorine supported on polystyrene; at 30 ℃; for 4h; optical yield given as %de;
DOI:10.1002/adsc.200800117

Reference yield: 98.0%

: 79-24-3
Nitroethane

: 122-57-6
1-Phenylbut-1-en-3-one

: 87774-43-4
(+/-)-5-nitro-4-phenylhexan-2-one

Guidance literature:: With C₂₆H₃₅N₅S; In ethyl acetate; at 20 ℃; for 48h;
DOI:10.1039/b804540b

Reference yield:

: 79-24-3
Nitroethane

: 122-57-6
1-Phenylbut-1-en-3-one

: 87774-43-4
5-nitro-4-phenylhexane-2-one

: (4S)-5-nitro-4-phenyl-hexan-2-one

Guidance literature:: With (1S)-(6-methoxyquinolin-4-yl)((1S,2S,4S)-5-vinylquinuclidin-2-yl)methanamine; In tetrahydrofuran; at 20 ℃; for 120h; Overall yield = 78 %; Optical yield = 94 %ee; enantioselective reaction;
DOI:10.1016/j.tetlet.2013.05.019