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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-1,2,3-Triazole-4-carbonitrile, 1-[(2,6-difluorophenyl)methyl]-

N#Cc1nnn(c1)Cc1c(F)cccc1F Request for Quotation
Chemical Name: 1H-1,2,3-Triazole-4-carbonitrile, 1-[(2,6-difluorophenyl)methyl]-
CAS Number: 202003-06-3
Product Number: AG0027ZO(AGN-PC-0NEX6R)
Synonyms:
MDL No:
Molecular Formula: C10H6F2N4
Molecular Weight: 220.1782

Identification/Properties

Properties
BP:
384.498°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
220.183g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
220.056g/mol
Monoisotopic Mass:
220.056g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
280
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


1-(2,6-Difluorobenzyl)-1H-1,2,3-triazole-4-carbonitrile is a versatile compound commonly utilized in chemical synthesis as a key building block for the creation of various complex organic molecules. This compound serves as an essential intermediate in the synthesis of biologically active compounds, pharmaceuticals, agrochemicals, and materials science applications. Its unique chemical structure enables it to participate in a variety of reactions, including transformations such as nucleophilic additions, cycloadditions, and metal-catalyzed processes. Additionally, the presence of the triazole and cyano groups in its structure imparts valuable properties to the final products, making it a valuable tool for medicinal chemists and organic synthesis practitioners seeking to develop new and innovative molecules.