4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl

Base Information

Chemical Name:4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl
CAS No.:80245-34-7
Molecular Formula:C13H8F3NO2
Molecular Weight:267.207
Hs Code.:2904909090
DSSTox Substance ID:DTXSID60457697
Nikkaji Number:J2.212.108A
Wikidata:Q82280642
Mol file:80245-34-7.mol

Synonyms:80245-34-7;4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl;1-Nitro-4-[4-(trifluoromethyl)phenyl]benzene;1-(4-nitrophenyl)-4-(trifluoromethyl)benzene;SCHEMBL5430351;DTXSID60457697;4-Nitro-4'-trifluoromethylbiphenyl;MFCD21609607;4-nitro-4'-(trifluoromethyl)biphenyl;AKOS016001031;BS-24374

Suppliers and Price of 4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl

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

Crysdot
4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl 95+%
10g
$ 564.00

Crysdot
4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl 95+%
5g
$ 339.00

American Custom Chemicals Corporation
4-NITRO-4'-(TRIFLUOROMETHYL)-1,1'-BIPHENYL 95.00%
5MG
$ 502.87

Alichem
4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl
10g
$ 552.90

AK Scientific
1-Nitro-4-[4-(trifluoromethyl)phenyl]benzene
5g
$ 531.00

Total 10 raw suppliers

Chemical Property of 4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl

Chemical Property:

Melting Point:121-122 °C
Boiling Point:331.7±37.0 °C(Predicted)
PSA：45.82000
Density:1.335±0.06 g/cm3(Predicted)
LogP:4.80380
Storage Temp.:2-8°C
XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:267.05071298
Heavy Atom Count:19
Complexity:311

Purity/Quality:

97% ^*data from raw suppliers

4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])C(F)(F)F

Technology Process of 4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl

There total 11 articles about 4-Nitro-4'-(trifluoromethyl)-1,1'-biphenyl 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: 100.0%

: 128796-39-4
4-trifluoromethylphenylboronic acid

: 586-78-7
para-nitrophenyl bromide

: 80245-34-7
4-nitro-4’-(trifluoromethyl)biphenyl

Guidance literature:: With potassium carbonate; Pd(OAc)2*(1,1,3,3-tetramethyl-2-n-butylguanidine)2; In ethanol; water monomer; at 20 ℃; for 1h;
DOI:10.1021/jo0626257

Reference yield: 99.0%

: 128796-39-4
4-trifluoromethylphenylboronic acid

: 100-00-5
4-chlorobenzonitrile

: 80245-34-7
4-nitro-4’-(trifluoromethyl)biphenyl

Guidance literature:: With sodium tetrachloropalladate(II); 5-[3-(4-carboxy-2,6-dimethylphenyl)-2-thioxoimidazolidin-1-yl]benzene-1,2,3-tricarboxylic acid; tetrabutylammomium bromide; potassium hydroxide; In water; at 100 ℃; for 12h; Sealed tube;
DOI:10.1055/s-0036-1589150

Reference yield: 99.0%

: 636-98-6
p-nitrobenzene iodide

: 128796-39-4
4-trifluoromethylphenylboronic acid

: 80245-34-7
4-nitro-4’-(trifluoromethyl)biphenyl

Guidance literature:: With potassium carbonate; In ethanol; at 80 ℃; for 0.5h; Reagent/catalyst; Catalytic behavior;
DOI:10.1055/s-0040-1705989