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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1H-1,2,4-Triazole, 3-(4-fluorophenyl)-

Fc1ccc(cc1)c1[nH]cnn1 Request for Quotation
Chemical Name: 1H-1,2,4-Triazole, 3-(4-fluorophenyl)-
CAS Number: 95728-10-2
Product Number: AG00IJET(AGN-PC-0OO732)
Synonyms:
MDL No:
Molecular Formula: C8H6FN3
Molecular Weight: 163.1517

Identification/Properties

Computed Properties
Molecular Weight:
163.155g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
163.055g/mol
Monoisotopic Mass:
163.055g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
145
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-(4-Fluorophenyl)-1H-1,2,4-triazole is a versatile compound commonly utilized in chemical synthesis as a key building block. Its unique structure and reactivity make it an essential component in the creation of various organic compounds, pharmaceuticals, agrochemicals, and functional materials. This compound serves as a valuable intermediate in the synthesis of pharmaceutical drugs, specifically in the development of antimicrobial agents, antifungal medications, and potential anticancer therapies. Additionally, 3-(4-Fluorophenyl)-1H-1,2,4-triazole plays a crucial role in the preparation of novel materials with tailored properties, such as fluorescent dyes, polymers, and ligands for catalysis. Its strategic incorporation in chemical reactions enables researchers to access diverse molecular architectures and explore new avenues in the synthesis of complex molecules with enhanced biological activities and material properties.