For research use only. Not for therapeutic Use.
3,4,5-Trifluorobenzonitrile(Cat No.:M107674)is an aromatic organic compound featuring a benzene ring substituted with three fluorine atoms at the 3-, 4-, and 5-positions, and a nitrile group at the 1-position. This highly electron-deficient molecule is a valuable intermediate in pharmaceutical and agrochemical synthesis, often used to introduce trifluorinated aromatic motifs into target compounds. The nitrile group enhances its reactivity in nucleophilic aromatic substitution and cross-coupling reactions. Its unique electronic properties and fluorine content contribute to improved metabolic stability, bioavailability, and binding affinity in drug design and advanced material development.
CAS Number | 134227-45-5 |
Molecular Formula | C7H2F3N |
Purity | ≥95% |
Storage | Store at RT |
IUPAC Name | 3,4,5-trifluorobenzonitrile |
InChI | InChI=1S/C7H2F3N/c8-5-1-4(3-11)2-6(9)7(5)10/h1-2H |
InChIKey | XFKYJMGXZXJYBS-UHFFFAOYSA-N |
SMILES | C1=C(C=C(C(=C1F)F)F)C#N |
Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |