Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-

Base Information

Chemical Name:Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-
CAS No.:1983-22-8
Molecular Formula:C9H4F3NO2
Molecular Weight:215.131
Hs Code.:
DSSTox Substance ID:DTXSID80451733
Nikkaji Number:J857.053A
Wikidata:Q82271916

Synonyms:1983-22-8;Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-;1-NITRO-4-(3,3,3-TRIFLUORO-1-PROPYN-1-YL)-BENZENE;DTXSID80451733;IWZPXBRMUFWHHZ-UHFFFAOYSA-N;1-nitro-4-(trifluoroprop-1-yn-1-yl)benzene;EN300-743698;1-(4-Nitrophenyl)-3,3,3-trifluoro-1-propyne

Suppliers and Price of Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-

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
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Total 1 raw suppliers

Chemical Property of Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:215.01941286
Heavy Atom Count:15
Complexity:299

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C#CC(F)(F)F)[N+](=O)[O-]

Technology Process of Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)-

There total 10 articles about Benzene, 1-nitro-4-(3,3,3-trifluoro-1-propynyl)- 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: 86.0%

: 94837-99-7
1-[2-chloro-3,3,3-trifluoro-1-propenyl]-4-nitrobenzene

: 1983-22-8
1-nitro-4-(3,3,3-trifluoroprop-1-yn-1-yl)benzene

Guidance literature:: With N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide; In dichloromethane; water; for 48h; Reflux;
DOI:10.1055/s-0029-1216697

Reference yield: 85.0%

: 82203-90-5
α-(trifluoroacetyl)-p-nitrobenzylidenetriphenylphosphorane

: 1983-22-8
1-nitro-4-(3,3,3-trifluoroprop-1-yn-1-yl)benzene

Guidance literature:: at 280 ℃; under 10 Torr;
DOI:10.1016/S0040-4039(00)86826-4

Reference yield: 68.0%

: 937-31-5
(4-Nitrophenyl)acetylene

: 2,2‐difluoro‐2‐(triphenylphosphonio)acetate

: 1983-22-8
1-nitro-4-(3,3,3-trifluoroprop-1-yn-1-yl)benzene

Guidance literature:: With potassium fluoride; tetrakis(actonitrile)copper(I) hexafluorophosphate; 18-crown-6 ether; chloranil; In N,N-dimethyl-formamide; at 40 ℃; for 2h; Inert atmosphere; Schlenk technique;
DOI:10.1002/cjoc.201400427