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CAS 944451-28-9

:

[1,1′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-diphenylphosphine-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′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-diphenylphosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium" and CAS number "944451-28-9" is a complex organometallic compound featuring a ruthenium center coordinated with various ligands. This compound is characterized by its unique structural features, including a bidentate phosphine ligand and a dioxole moiety, which contribute to its stability and reactivity. The presence of dichloro groups indicates potential for substitution reactions, making it useful in catalysis. The compound's architecture allows for specific interactions with substrates, enhancing its catalytic properties in organic transformations. Additionally, the chirality introduced by the (4R) configuration may influence its reactivity and selectivity in asymmetric synthesis. Overall, this ruthenium complex exemplifies the intricate design of organometallic compounds for applications in catalysis and materials science.
Formula:C48H42Cl2O4P2Ru
InChI:InChI=1S/C38H28O4P2.C10H14.2ClH.Ru/c1-5-13-27(14-6-1)43(28-15-7-2-8-16-28)33-23-21-31-37(41-25-39-31)35(33)36-34(24-22-32-38(36)42-26-40-32)44(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-8(2)10-6-4-9(3)5-7-10;;;/h1-24H,25-26H2;4-8H,1-3H3;2*1H;/q;;;;+2/p-2
InChI key:InChIKey=HZLSGDCLBWZKRB-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=CC=C%10)C%11=CC=CC=C%11)=CC=C%12C9OCO%12)=C%13C(=CC8)OCO%13)(C%14=CC=CC=C%14)C%15=CC=CC=C%15
Synonyms:
  • (R)− RuCl[(p− Cymene)(SEGPHOS)]Cl
  • Ruthenium, [1,1′-(4R)-[4,4′-bi-1,3-benzodioxole]-5,5′-diylbis[1,1-diphenylphosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]-
  • [1,1′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-diphenylphosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium
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