1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane

Base Information

Chemical Name:1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane
CAS No.:60526-66-1
Molecular Formula:C14H16FNO2
Molecular Weight:249.285
Hs Code.:
DSSTox Substance ID:DTXSID10506285
Wikidata:Q82361977

Synonyms:60526-66-1;1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane;DTXSID10506285;1-Fluoro-4-(4-nitro-phenyl)-bicyclo[2.2.2]octane

Suppliers and Price of 1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane

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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price

Total 1 raw suppliers

Chemical Property of 1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:249.11650692
Heavy Atom Count:18
Complexity:320

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2(CCC1(CC2)C3=CC=C(C=C3)[N+](=O)[O-])F

Technology Process of 1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane

There total 4 articles about 1-Fluoro-4-(4-nitrophenyl)bicyclo[2.2.2]octane 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: 59.5%

: 78016-67-8
1-hydroxy-4-(4-nitrophenyl)bicyclo<2.2.2>octane

: 60526-66-1
1-fluoro-4-(4-nitrophenyl)bicyclo<2.2.2>octane

Guidance literature:: With N-(2-chloro-1,1,2-trifluoroethyl)diethylamine; at 130 ℃; for 1.5h;

Reference yield:

: 54986-35-5
1-acetoxy-4-phenylbicyclo<2.2.2>octane

: 60526-66-1
1-fluoro-4-(4-nitrophenyl)bicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 3 steps

1: 66 percent / HNO₃ / acetic anhydride / 1) 25 deg C, 20 min; 2) stirring, 4 h.

2: 100 percent / NaOH / H₂O; methanol / 2 h / Heating

3: 59.5 percent / 2-chloro-1,1,2-trifluorotriethylamine / 1.5 h / 130 °C

With N-(2-chloro-1,1,2-trifluoroethyl)diethylamine; sodium hydroxide; nitric acid; In methanol; water; acetic anhydride;

Reference yield:

: 78016-68-9
1-acetoxy-4-(4-nitrophenyl)bicyclo<2.2.2>octane

: 60526-66-1
1-fluoro-4-(4-nitrophenyl)bicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 2 steps

1: 100 percent / NaOH / H₂O; methanol / 2 h / Heating

2: 59.5 percent / 2-chloro-1,1,2-trifluorotriethylamine / 1.5 h / 130 °C

With N-(2-chloro-1,1,2-trifluoroethyl)diethylamine; sodium hydroxide; In methanol; water;