Description

2,3a(2),5a(2)-Trifluoro-4-propyl-1,1a(2)-biphenyl (CAS No. 953049-36-0) is a high-purity fluorinated biphenyl derivative with the molecular formula C₁₅H₁₃F₃. This specialized organic compound is designed for advanced research applications, particularly in materials science, pharmaceuticals, and agrochemical development. The unique trifluorinated structure, combined with the propyl substituent, offers exceptional electronic properties and stability, making it valuable for designing novel liquid crystals, OLED materials, or bioactive molecules. Each batch undergoes rigorous QC testing including GC/MS, HPLC, and NMR to ensure >98% purity. Supplied in amber glass vials under inert atmosphere to maintain stability. Suitable for use as a building block in cross-coupling reactions, fluorophore synthesis, or as a reference standard.

Properties

• CAS Number: 953049-36-0
• Complexity: 246
• IUPAC Name: 1,3-difluoro-5-(2-fluoro-4-propyl-phenyl)benzene
• InChI: InChI=1S/C15H13F3/c1-2-3-10-4-5-14(15(18)6-10)11-7-12(16)9-13(17)8-11/h4-9H,2-3H2,1H3
• InChI Key: SNYCLEXKLWBWTK-UHFFFAOYSA-N
• Exact Mass: 250.09693490
• Molecular Formula: C15H13F3
• Molecular Weight: 250.26
• SMILES: CCCC1=CC(=C(C=C1)C2=CC(=CC(=C2)F)F)F
• Monoisotopic Mass: 250.09693490
• Synonyms: SCHEMBL16592464, DTXSID201277242, 2,3a(2),5a(2)-Trifluoro-4-propyl-1,1a(2)-biphenyl, 953049-36-0

Application

This fluorinated biphenyl derivative serves as a key intermediate in the synthesis of advanced materials with unique optoelectronic properties. Researchers utilize it in the development of liquid crystal displays (LCDs) and organic light-emitting diodes (OLEDs) due to its stable fluorinated structure. The compound’s rigid biphenyl core makes it valuable for pharmaceutical research, particularly in creating novel bioactive molecules with enhanced metabolic stability. Its structural features also make it suitable for studying structure-property relationships in materials science applications.

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