| Identification | Back Directory | [Name]
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyl-Oxazole | [CAS]
157904-67-1 | [Synonyms]
（4R，4'R，5S，5'S）-
(R,S)-BisPh-propabBox
(4R,4μR,5S,5μS)-2,2μ-(1-Methylethylidene
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene 95%
2,2-Bis[2-(4R,5S-diphenyl-1,3-oxazolinyl)]propane, 95%
(4R,4’R,5S,5’S)-2,2’-(Propane-2,2-diyl)bis(4,5-diphenyl-4,5-dihydrooxazole)
(4R,4’R,5S,5’S)-2,2’-(Propane-2,2-diyl)bis(4,5-diphenyl-4,5-dihydrooxazole)
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyloxazole
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyl-Oxazole
(4R,4''R,5S,5''S)-2,2''-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyloxazole]
Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4,5-diphenyl-, (4R,4'R,5S,5'S)-
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyloxazole],99%e.e.
(4R,4'R,5S,5'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4,5-diphenyloxazole], 98%, (99% ee) | [Molecular Formula]
C33H30N2O2 | [MDL Number]
MFCD24849939 | [MOL File]
157904-67-1.mol | [Molecular Weight]
486.6 |
| Chemical Properties | Back Directory | [Melting point ]
164-169°C | [Boiling point ]
606.7±55.0 °C(Predicted) | [density ]
1.16±0.1 g/cm3(Predicted) | [storage temp. ]
under inert gas (nitrogen or Argon) at 2-8°C | [form ]
solid | [pka]
4.33±0.70(Predicted) | [Appearance]
White to off-white Solid | [InChIKey]
ZWWGNCSTEMMQOQ-XAZDILKDSA-N | [SMILES]
CC(C1=N[C@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)O1)(C)C4=N[C@H](C5=CC=CC=C5)[C@H](C6=CC=CC=C6)O4 |
| Hazard Information | Back Directory | [Uses]
(4R,4′R,5S,5′S)-2,2′-(1-Methylethylidene) or (4S,5R)-Bis-Phbox) can be used as a ligand:
- To prepare selective exo-catalysts for enantioselective 1,3-dipolar cycloaddition reactions.
- In the asymmetric aminooxygenation of alkenes in the presence of tetramethylaminopyridyl radical (TEMPO) as an oxidant and copper(II) triflate as a catalyst.
- In asymmetric aminofluorination of olefins using an iron catalyst.
This chiral Box ligand was most recently shown to mediate an asymmetric aminofluorination of olefins utlizing Xtalfuor-E (719439) and TREAT-HF (344648). The resulting cyclic carbamates can be readily converted into their concomitant beta-fluoro amino acids. |
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