Description
Phosphoric acid, bis(pentafluorophenyl) phenyl ester (CAS 59616-63-6) is a highly specialized organophosphorus compound with the molecular formula C18H5F10O4P. Also known as bis(2,3,4,5,6-pentafluorophenyl) phenyl phosphate, this fluorinated phosphate ester exhibits exceptional thermal and chemical stability, making it a valuable reagent for advanced synthetic and catalytic applications. Its unique structure, featuring electron-withdrawing pentafluorophenyl groups, enhances its utility as a ligand or intermediate in organometallic chemistry, flame retardancy research, and specialty polymer modification. This product is supplied as a high-purity solid with rigorous QC validation, ensuring consistency for sensitive experimental workflows. Store under inert conditions to maintain stability.
Properties
- CAS Number: 59616-63-6
- Complexity: 627
- IUPAC Name: bis(2,3,4,5,6-pentafluorophenyl) phenyl phosphate
- InChI: InChI=1S/C18H5F10O4P/c19-7-9(21)13(25)17(14(26)10(7)22)31-33(29,30-6-4-2-1-3-5-6)32-18-15(27)11(23)8(20)12(24)16(18)28/h1-5H
- InChI Key: QGGSSFMIXKESPP-UHFFFAOYSA-N
- Exact Mass: 505.97657725
- Molecular Formula: C18H5F10O4P
- Molecular Weight: 506.2
- SMILES: C1=CC=C(C=C1)OP(=O)(OC2=C(C(=C(C(=C2F)F)F)F)F)OC3=C(C(=C(C(=C3F)F)F)F)F
- Topological: 44.8
- Monoisotopic Mass: 505.97657725
- Synonyms: 59616-63-6, Bis(perfluorophenyl) phenyl phosphate, Phosphoric acid, bis(pentafluorophenyl) phenyl ester, SCHEMBL21117276
Application
This fluorinated phosphate ester serves as a key intermediate in the synthesis of flame-retardant additives for high-performance polymers. Researchers employ it as a ligand precursor in transition metal catalysis, particularly for reactions requiring electron-deficient phosphates. Its stability under harsh conditions also makes it suitable for studying degradation mechanisms in fluorinated materials.
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