1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-

Base Information

Chemical Name:1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-
CAS No.:586333-33-7
Molecular Formula:C16H10BrF3N2
Molecular Weight:367.168
Hs Code.:
DSSTox Substance ID:DTXSID60435132

Synonyms:586333-33-7;1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-;5-(4-Bromophenyl)-1-phenyl-3-(trifluoromethyl)-1H-pyrazole;DTXSID60435132;NWYHRYOPEBHPIG-UHFFFAOYSA-N

Suppliers and Price of 1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-

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 1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-

Chemical Property:

XLogP3:5.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:365.99795
Heavy Atom Count:22
Complexity:363

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)Br

Technology Process of 1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)-

There total 7 articles about 1H-Pyrazole, 5-(4-bromophenyl)-1-phenyl-3-(trifluoromethyl)- 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: 99.0%

: 4-(4-bromophenyl)-1,1,1-trifluorobut-3-yn-2-one

: 59-88-1
phenylhydrazine hydrochloride

: 586333-33-7
1-phenyl-3-(trifluoromethyl)-5-(4-bromophenyl)-1H-pyrazole

Guidance literature:: phenylhydrazine hydrochloride; With 1,8-diazabicyclo[5.4.0]undec-7-ene;

4-(4-bromophenyl)-1,1,1-trifluorobut-3-yn-2-one; for 24h; regioselective reaction;
DOI:10.1021/acs.joc.7b00774

Reference yield: 94.0%

: 4-(4-bromophenyl)-1,1,1-trifluorobut-3-yn-2-one

: 100-63-0
phenylhydrazine

: 586333-33-7
1-phenyl-3-(trifluoromethyl)-5-(4-bromophenyl)-1H-pyrazole

Guidance literature:: With silver trifluoromethanesulfonate; In chloroform; at 20 ℃; for 1h; regioselective reaction; Sealed tube;
DOI:10.1002/ejoc.201800208