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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)-

1,3-Benzenedicarbonitrile, 4-fluoro-

N#Cc1ccc(c(c1)C#N)F Request for Quotation
Chemical Name: 1,3-Benzenedicarbonitrile, 4-fluoro-
CAS Number: 13519-90-9
Product Number: AG007LIB(AGN-PC-0JMYYG)
Synonyms:
MDL No: MFCD01657003
Molecular Formula: C8H3FN2
Molecular Weight: 146.1212

Identification/Properties

Computed Properties
Molecular Weight:
146.124g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
146.028g/mol
Monoisotopic Mass:
146.028g/mol
Topological Polar Surface Area:
47.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
231
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Fluoroisophthalonitrile is a valuable chemical compound used in various chemical synthesis processes. It serves as a versatile building block in the preparation of functional materials and complex organic molecules. In organic synthesis, 4-Fluoroisophthalonitrile is commonly employed as a key intermediate in the production of pharmaceuticals, agrochemicals, dyes, and polymers.Its unique molecular structure allows for the introduction of fluorine atoms into target molecules, imparting desirable properties such as improved stability, bioavailability, and biological activity. By incorporating 4-Fluoroisophthalonitrile into synthetic pathways, chemists can access a diverse range of fluorinated compounds with tailored functionalities.Furthermore, 4-Fluoroisophthalonitrile exhibits excellent reactivity towards various reagents and can undergo a variety of transformations including nucleophilic substitution, cross-coupling reactions, and metal-catalyzed processes. This broad reactivity profile makes it a valuable tool for designing novel chemical entities with enhanced performance and potential applications in pharmaceutical research, materials science, and organic electronics.