Description
1-[[2,6-Difluoro-4-(4-propylphenyl)phenyl]-difluoromethoxy]-3,4,5-trifluoro-2-methylbenzene (CAS No. 1690317-23-7) is a highly fluorinated aromatic compound with the molecular formula C23H17F7O. This specialty chemical is designed for advanced research applications, particularly in the fields of organic synthesis, materials science, and pharmaceutical development. Its unique structure, featuring multiple fluorine substitutions and a propylphenyl group, makes it a valuable intermediate for constructing complex fluorinated molecules. The compound is supplied as a high-purity solid (>95%) with detailed analytical characterization, including 1H NMR, 19F NMR, and HPLC data available upon request. Proper storage at 2-8°C under inert atmosphere is recommended to maintain stability.
Properties
- CAS Number: 1690317-23-7
- Complexity: 556
- IUPAC Name: 1-[[2,6-difluoro-4-(4-propylphenyl)phenyl]-difluoro-methoxy]-3,4,5-trifluoro-2-methyl-benzene
- InChI: InChI=1S/C23H17F7O/c1-3-4-13-5-7-14(8-6-13)15-9-16(24)20(17(25)10-15)23(29,30)31-19-11-18(26)22(28)21(27)12(19)2/h5-11H,3-4H2,1-2H3
- InChI Key: QXDAODVIURYQBR-UHFFFAOYSA-N
- Exact Mass: 442.11676230
- Molecular Formula: C23H17F7O
- Molecular Weight: 442.4
- SMILES: CCCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3C)F)F)F)(F)F)F
- Topological: 9.2
- Monoisotopic Mass: 442.11676230
- Synonyms: tFMePO-CF2-dF3B, SCHEMBL18160349, QXDAODVIURYQBR-UHFFFAOYSA-N, 4-[difluoro(2-methyl-3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-4′-propylbiphenyl, 1,1′-Biphenyl, 4-[difluoro(3,4,5-trifluoro-2-methylphenoxy)methyl]-3,5-difluoro-4′-propyl-, 1-[[2,6-Difluoro-4-(4-propylphenyl)phenyl]-difluoromethoxy]-3,4,5-trifluoro-2-methylbenzene, 1690317-23-7
Application
This fluorinated biphenyl derivative serves as a key building block in the synthesis of advanced materials with tailored electronic properties. Researchers utilize it in the development of liquid crystal compounds for display technologies due to its stable mesogenic core. The compound’s multiple fluorine atoms make it particularly interesting for studying structure-activity relationships in medicinal chemistry, especially for CNS-targeting pharmaceuticals. Its unique electronic properties also show promise in organic electronic applications.
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