Dichloro{(R)-(+)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole}[(1R,2R)-(+)-1,2-diphenylethylenediamine]ruthenium(II) RuCl2[(R)-dm-segphos][(R,R)-dpen]


Chemical Name: Dichloro{(R)-(+)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole}[(1R,2R)-(+)-1,2-diphenylethylenediamine]ruthenium(II) RuCl2[(R)-dm-segphos][(R,R)-dpen]
CAS Number: 944450-45-7
Product Number: AG003U5J(AGN-PC-0W41MO)
Synonyms:
MDL No:
Molecular Formula: C60H60Cl2N2O4P2Ru
Molecular Weight: 1107.0529

Identification/Properties


Properties
Storage:
Inert atmosphere;2-8℃;
Computed Properties
Molecular Weight:
1107.068g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
10
Exact Mass:
1106.245g/mol
Monoisotopic Mass:
1106.245g/mol
Topological Polar Surface Area:
89A^2
Heavy Atom Count:
71
Formal Charge:
0
Complexity:
1160
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H305-H316-H360-H371-H373
Precautionary Statements:
P201-P202-P260-P264-P270-P281-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



The complex Dichloro{(R)-(+)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole}[(1R,2R)-(+)-1,2-diphenylethylenediamine]ruthenium(II) is widely utilized in chemical synthesis as a powerful and versatile catalyst. It is particularly valued for its ability to facilitate asymmetric transformations in various organic reactions. In catalytic processes, this compound displays high efficiency and selectivity, making it a valuable tool for the production of chiral compounds with high enantiomeric purity. Its unique structure and ligand design enable it to activate substrates and control reaction pathways, leading to the formation of complex molecular structures with excellent control over stereochemistry. This ruthenium complex has found applications in a range of synthetic transformations, including asymmetric hydrogenation, carbon-carbon bond formation, and C-H activation reactions, showcasing its broad utility in modern synthetic chemistry.