5-(4-phenoxyphenyl)-1H-pyrazole

Base Information

Chemical Name:5-(4-phenoxyphenyl)-1H-pyrazole
CAS No.:111273-31-5
Molecular Formula:C15H12N2O
Molecular Weight:236.273
Hs Code.:
DSSTox Substance ID:DTXSID00384478
Wikidata:Q82176643
Pharos Ligand ID:TW931VQXRC3L
ChEMBL ID:CHEMBL41864
Mol file:111273-31-5.mol

Synonyms:5-(4-phenoxyphenyl)-1H-pyrazole;111273-31-5;1H-Pyrazole, 3-(4-phenoxyphenyl)-;CHEMBL41864;3-(4-Phenoxy-phenyl)-1H-pyrazole;Maybridge3_001296;D0M5VF;Oprea1_637414;MLS000851363;SCHEMBL3364770;DTXSID00384478;SGQSMRQYEPPNIA-UHFFFAOYSA-N;HMS1434K20;HMS2799J18;BDBM50141064;IDI1_012683;PD180941;SMR000457806

Suppliers and Price of 5-(4-phenoxyphenyl)-1H-pyrazole

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 5-(4-phenoxyphenyl)-1H-pyrazole

Chemical Property:

XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:236.094963011
Heavy Atom Count:18
Complexity:245

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC=NN3

Technology Process of 5-(4-phenoxyphenyl)-1H-pyrazole

There total 2 articles about 5-(4-phenoxyphenyl)-1H-pyrazole 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:

: 5031-78-7
4-phenoxyacetophenone

: 109-94-4
formic acid ethyl ester

: 111273-31-5
3-[4-phenoxyphenyl]pyrazole

Guidance literature:: With hydrazine hydrochloride; sodium methylate; Yield given. Multistep reaction; 1.) toluene, room temp., 2 h, 2.) methanol, water, 4 h;
DOI:10.1016/S0022-328X(96)06890-8

Reference yield:

: 111273-31-5
3-[4-phenoxyphenyl]pyrazole

Guidance literature:

Reference yield: 87.0%

: 12092-47-6
di-μ-chloro-bis(1,5-cyclooctadiene)dirhodium

: 111273-31-5
3-[4-phenoxyphenyl]pyrazole

: Rh⁽¹⁺⁾*H⁽¹⁺⁾*Cl^(1-)*N₂H₂C₃C₆H₄OC₆H₅^(1-)*C₈H₁₂=RhCl(N₂C₃H₃C₆H₄OC₆H₅)(C₈H₁₂)

Guidance literature:: In dichloromethane; stirring Rh-complex with 2 equiv. of pyrazole derivative (room temp., 2 h); concn., pptn. on hexane addn., filtration, washing (hexane), drying (vac.); elem. anal.;
DOI:10.1016/S0022-328X(96)06890-8