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CAS 878111-17-2

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Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin, 2,6-bis[3,5-bis(trifluoromethyl)phenyl]-4-hydroxy-, 4-oxide, (11bS)-

Description:
Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin, 2,6-bis[3,5-bis(trifluoromethyl)phenyl]-4-hydroxy-, 4-oxide, with CAS number 878111-17-2, is a complex organophosphorus compound characterized by its unique structural framework that includes a dioxaphosphepin core. This compound features multiple aromatic rings, specifically dinaphthyl moieties, which contribute to its stability and potential electronic properties. The presence of trifluoromethyl groups enhances its lipophilicity and may influence its reactivity and interaction with biological systems. The hydroxyl group indicates potential for hydrogen bonding, which can affect solubility and reactivity. Additionally, the compound's phosphine oxide functionality suggests it may exhibit interesting coordination chemistry and potential applications in catalysis or materials science. Overall, the combination of these structural elements suggests that this compound may possess unique physical and chemical properties, making it of interest in various fields, including medicinal chemistry and materials development.
Formula:C36H17F12O4P
InChI:InChI=1S/C36H17F12O4P/c37-33(38,39)21-9-19(10-22(15-21)34(40,41)42)27-13-17-5-1-3-7-25(17)29-30-26-8-4-2-6-18(26)14-28(32(30)52-53(49,50)51-31(27)29)20-11-23(35(43,44)45)16-24(12-20)36(46,47)48/h1-16H,(H,49,50)
InChI key:InChIKey=DQORDVSQWPKAQJ-UHFFFAOYSA-N
SMILES:O=P1(O)OC2=C(C3=C(C(=CC=4C3=CC=CC4)C5=CC(C(F)(F)F)=CC(C(F)(F)F)=C5)O1)C=6C(C=C2C7=CC(C(F)(F)F)=CC(C(F)(F)F)=C7)=CC=CC6
Synonyms:
  • (S)-(+)-3,3'-Bis(3,5-Bis(Trifluoromethyl)Phenyl)-1,1'-Binaphthyl-2,2'-Diyl Hydrogenphosphate
  • (S)-3,3′-Bis[3,5-bis(trifluoromethyl)phenyl]-2,2′-dihydroxy-1,1′-binaphthalene cyclic phosphate
  • Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin, 2,6-bis[3,5-bis(trifluoromethyl)phenyl]-4-hydroxy-, 4-oxide, (11bS)-
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