4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide

Base Information

Chemical Name:4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide
CAS No.:331434-05-0
Molecular Formula:C₉H₇FN₄O
Molecular Weight:206.179
Hs Code.:2933998090
DSSTox Substance ID:DTXSID201330939
ChEMBL ID:CHEMBL1506441
Mol file:331434-05-0.mol

Synonyms:4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide;331434-05-0;4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzenecarboxamide;4-fluoro-N-(1,2,4-triazol-4-yl)benzamide;CBMicro_017695;C9H7FN4O;MLS001165626;CHEMBL1506441;DTXSID201330939;HMS2873E17;CCG-6306;MFCD00448017;STK125662;AKOS000612291;SMR000550094;BIM-0017654.P001;CS-0157528;D80723;4R-0015

Suppliers and Price of 4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide

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

Apolloscientific
4-Fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide tech
1g
$ 950.00

Total 2 raw suppliers

Chemical Property of 4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide

Chemical Property:

PKA:6.39±0.70(Predicted)
Density:1.41±0.1 g/cm3(Predicted)
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:206.06038902
Heavy Atom Count:15
Complexity:224

Purity/Quality:

99% ^*data from raw suppliers

4-Fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide tech ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)NN2C=NN=C2)F

Technology Process of 4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide

There total 1 articles about 4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide 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: 66.0%

: 584-13-4
4-amino-1,2,4-triazole

: 352-34-1
4-fluoro-1-iodobenzene

: 201230-82-2
carbon monoxide

: 331434-05-0
4-fluoro-N-(4H-1,2,4-triazol-4-yl)benzamide

Guidance literature:: With palladium diacetate; triethylamine; triphenylphosphine; In N,N-dimethyl-formamide; at 70 ℃; for 48h; under 750.075 Torr; chemoselective reaction;
DOI:10.1016/j.tet.2017.10.017