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Tris(2,4-Pentanedionato) Ruthenium(III)

Catalog Number
ACM14284936-4
Product Name
Tris(2,4-Pentanedionato) Ruthenium(III)
Structure
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CAS
14284-93-6
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Synonyms
Ruthenium(III) acetylacetonate; Ruthenium(III) 2,4-pentanedionate
IUPAC Name
(Z)-4-hydroxypent-3-en-2-one;ruthenium
Molecular Weight
401.4
Molecular Formula
C15H24O6Ru
Canonical SMILES
CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Ru]
InChI
1S/3C5H8O2.Ru/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/b3*4-3-
InChI Key
IYWJIYWFPADQAN-LNTINUHCSA-N
Complexity
380
Covalently-Bonded Unit Count
4
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
3
EC Number
238-193-0
Exact Mass
402.061629
H-Bond Acceptor
6
H-Bond Donor
3
Isomeric SMILES
C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Ru]
Metal Content
0.254
Monoisotopic Mass
112 Ų
Physical State
Solid
Rotatable Bond Count
402.061629
Topological Polar Surface Area
22
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
UNII
3
Application
Tris(2,4-Pentanedionato) Ruthenium(III) serves as a versatile dark-red crystalline precursor crucial for synthesizing various ruthenium compounds. This compound plays a significant role as a recyclable catalyst in organic chemistry, facilitating the acetylation of phenols, alcohols, and amines under neat conditions. Additionally, it is employed as a homogeneous catalyst in reactions like the hydrolysis of sodium borohydride and regiospecific tritiation of aromatic carboxylic acids. Furthermore, it is utilized as a catalyst in the enantioselective hydrogenation of acids, including aryl acrylic acid and aryl propenic acid, highlighting its utility in diverse chemical transformations.
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