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CAS 944451-25-6

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[1,1′-(1S)-[1,1′-Binaphthalene]-2,2′-diylbis[1,1-bis(3,5-dimethylphenyl)phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium

Description:
The chemical substance with the name "[1,1′-(1S)-[1,1′-Binaphthalene]-2,2′-diylbis[1,1-bis(3,5-dimethylphenyl)phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium" and CAS number "944451-25-6" is a complex organometallic compound featuring a ruthenium center coordinated with various ligands. This compound is characterized by its chiral binaphthalene backbone, which contributes to its stereochemical properties, making it potentially useful in asymmetric catalysis. The presence of bisphosphine ligands enhances its stability and reactivity, while the dichloro and η6-arene coordination provide additional electronic and steric properties. Such complexes are often studied for their catalytic applications in organic synthesis, particularly in reactions involving C-C bond formation. The intricate structure and the presence of bulky substituents suggest that it may exhibit unique reactivity patterns, making it a subject of interest in the field of coordination chemistry and catalysis. Overall, this compound exemplifies the intersection of organometallic chemistry and asymmetric synthesis.
Formula:C62H62Cl2P2Ru
InChI:InChI=1S/C52H48P2.C10H14.2ClH.Ru/c1-33-21-34(2)26-43(25-33)53(44-27-35(3)22-36(4)28-44)49-19-17-41-13-9-11-15-47(41)51(49)52-48-16-12-10-14-42(48)18-20-50(52)54(45-29-37(5)23-38(6)30-45)46-31-39(7)24-40(8)32-46;1-8(2)10-6-4-9(3)5-7-10;;;/h9-32H,1-8H3;4-8H,1-3H3;2*1H;/q;;;;+2/p-2
InChI key:InChIKey=CBZXDZCPCDMKJU-UHFFFAOYSA-L
SMILES:[Cl-][Ru+2]123456([Cl-])(C=7(C(C)C)[CH]1=[CH]2C3(C)=[CH]4[CH]57)[P](C=8C(C=9C([P]6(C%10=CC(C)=CC(C)=C%10)C%11=CC(C)=CC(C)=C%11)=CC=C%12C9C=CC=C%12)=C%13C(=CC8)C=CC=C%13)(C%14=CC(C)=CC(C)=C%14)C%15=CC(C)=CC(C)=C%15
Synonyms:
  • Ruthenium, [1,1′-(1S)-[1,1′-binaphthalene]-2,2′-diylbis[1,1-bis(3,5-dimethylphenyl)phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]-
  • [1,1′-(1S)-[1,1′-Binaphthalene]-2,2′-diylbis[1,1-bis(3,5-dimethylphenyl)phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium
  • [RuCl(p-cymene)((S)-xylbinap)]Cl
  • Chloro{(S)-(-)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride [RuCl(p-cymene)((S)-xylbinap)]Cl
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