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  • ((4S,5S)-(-)-O-[1-Benzyl-1-(5-methyl-2-phenyl-4,5-dihydrooxazol-4-yl)-2-phenylethyl]-dicyclohexylphosphinite)(1,5-COD)iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenylborate, min. 97% (S,S)-[COD]Ir[cy2PThrePHOX]

((4S,5S)-(-)-O-[1-Benzyl-1-(5-methyl-2-phenyl-4,5-dihydrooxazol-4-yl)-2-phenylethyl]-dicyclohexylphosphinite)(1,5-COD)iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenylborate, min. 97% (S,S)-[COD]Ir[cy2PThrePHOX]

Catalog Number
ACM583844386
Product Name
((4S,5S)-(-)-O-[1-Benzyl-1-(5-methyl-2-phenyl-4,5-dihydrooxazol-4-yl)-2-phenylethyl]-dicyclohexylphosphinite)(1,5-COD)iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenylborate, min. 97% (S,S)-[COD]Ir[cy2PThrePHOX]
Structure
((4S,5S)-(-)-O-[1-Benzyl-1-(5-methyl-2-phenyl-4,5-dihydrooxazol-4-yl)-2-phenylethyl]-dicyclohexylphosphinite)(1,5-COD)iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenylborate, min. 97% (S,S)-[COD]Ir[cy2PThrePHOX]
CAS
583844-38-6
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Synonyms
(S,S)-[COD]IR[CY2PTHREPHOX]; 583844-38-6; ((4S,5S)-(-)-O-[1-BENZYL-1-(5-METHYL-2-PHENYL-4,5-DIHYDROOXAZOL-4-YL)-2-PHENYLETHYL]-DICYCLOHEXYLPHOSPHINITE)(1,5-COD)IRIDIUM(I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYLBORATE); 1,5-CYCLOOCTADIENE[[DIBENZYL((4S,5S)-5-METHYL-2-PHENYL-4,5-DIHYDRO-4-OXAZOLYL)METHYL]DICYCLOHEXYLPHOSPHINITE KAPPAN:KAPPAP]IRIDIUM(I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYL)BORATE; [((4S,5S)-Cy2-Ubaphox)Ir(COD)]BARF;
IUPAC Name
cyclooctane;dicyclohexyl-[2-[(4S,5S)-5-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]-1,3-diphenylpropan-2-yl]oxyphosphane;iridium;tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide;
Molecular Weight
1731.374g/mol
Molecular Formula
C77H70BF24IrNO2P-;
InChI
InChI=1S/C37H46NO2P.C32H12BF24.C8H12.Ir/c1-29-35(38-36(39-29)32-21-11-4-12-22-32)37(27-30-17-7-2-8-18-30,28-31-19-9-3-10-20-31)40-41(33-23-13-5-14-24-33)34-25-15-6-16-26-34;34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-2-4-6-8-7-5-3-1;/h2-4,7-12,17-22,29,33-35H,5-6,13-16,23-28H2,1H3;1-12H;1-2,7-8H,3-6H2;/q;-1;;/t29-,35-;;;/m0.../s1;
InChI Key
LADOFGASZSKWMF-FWAHSXEBSA-N;
Complexity
1850
Covalently-Bonded Unit Count
4
Defined Atom Stereocenter Count
2
Exact Mass
1731.448g/mol
Formal Charge
-1
H-Bond Acceptor
28
Heavy Atom Count
107
Monoisotopic Mass
1731.448g/mol
Rotatable Bond Count
14
Topological Polar Surface Area
30.8A^2
Application
Iridium-catalyzed asymmetric hydrogenation of N-protected indoles.

Iridium-catalyzed asymmetric hydrogenation of unfunctionalized enamines.
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