Description

3-Fluorophthalonitrile (CAS No. 65610-13-1) is a high-purity fluorinated aromatic compound with the molecular formula C₈H₃FN₂. This specialty chemical, also known as 3-fluorobenzene-1,2-dicarbonitrile, is a key intermediate in the synthesis of advanced materials, including phthalocyanine derivatives and fluorinated polymers. Its unique structure, featuring both fluorine and nitrile functional groups, enables precise modifications in organic and organometallic chemistry. Ideal for researchers in materials science, pharmaceuticals, and agrochemicals, this compound is rigorously tested for consistency and purity (typically ≥97% by GC). Available in sealed packaging under inert conditions to ensure stability.

Properties

• CAS Number: 65610-13-1
• Complexity: 231
• IUPAC Name: 3-fluorophthalonitrile
• InChI: InChI=1S/C8H3FN2/c9-8-3-1-2-6(4-10)7(8)5-11/h1-3H
• InChI Key: SAPTYURANIHAPE-UHFFFAOYSA-N
• Exact Mass: 146.02802627
• Molecular Formula: C8H3FN2
• Molecular Weight: 146.12
• SMILES: C1=CC(=C(C(=C1)F)C#N)C#N
• Topological: 47.6
• Monoisotopic Mass: 146.02802627
• Synonyms: 3-fluorophthalonitrile, 65610-13-1, 3-FLUOROPHTHALODINITRILE, 3-fluorobenzene-1,2-dicarbonitrile, 3-FLUORO-1,2-BENZENEDICARBONITRILE, 1,2-Dicyano-3-fluorobenzene, 1,2-Benzenedicarbonitrile, 3-fluoro-, MFCD00052458, fluorophthalonitrile, SCHEMBL186554, DTXSID70474794, SAPTYURANIHAPE-UHFFFAOYSA-N, CL8195, SBB059251, AKOS005063967, AC-9708, FF67011, GS-4376, DB-011201, CS-0157258, ST51044339

Application

3-Fluorophthalonitrile is widely used as a precursor in the synthesis of fluorinated phthalocyanines, which are critical for dye-sensitized solar cells (DSSCs) and organic semiconductors. Its nitrile groups facilitate polymerization reactions, making it valuable in creating high-performance polymers with enhanced thermal and chemical resistance. Researchers also employ it in medicinal chemistry to develop fluorinated bioactive molecules.

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