Triruthenium dodecacarbonyl - ≥99.95% metals basis , CAS No.15243-33-1

CAS: 15243-33-1 Cat. No.: T294758 Molecular Weight: 639.33 EC Number: 239-287-4 PubChem CID: 6096991

GRADE & PURITY ≥99.95% metals basis

Synonyms

Umicore DeRu37 | SY009926 | T71827 | Triruthenium dodecacarbonyl, 99% | AKOS015916383 | Q2115937 | Ru3 (CO)12 | DODECACARBONYLTRIRUTHENIUM;DODECACARBONYLTRIRUTHENIUM (0);RUTHENIUM CARBONYL;TRIRUTHENIUM DODECACARBONYL | dodecakis(methanidylidyneoxidanium)

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

Carbonyl cluster precursor and H-transfer catalyst.

Product class

Homogeneous Catalysts, Electronic Materials, PGM based Electronic Materials, M-(CO)

Reaction type

Carbonylation, Decarboxylation, Hydroamination

Specifications

Synonyms

Umicore DeRu37 | SY009926 | T71827 | Triruthenium dodecacarbonyl, 99% | AKOS015916383 | Q2115937 | Ru3 (CO)12 | DODECACARBONYLTRIRUTHENIUM;DODECACARBONYLTRIRUTHENIUM (0);RUTHENIUM CARBONYL;TRIRUTHENIUM DODECACARBONYL | dodecakis(methanidylidyneoxidanium)

Specifications & Purity

≥99.95% metals basis

Legal Information

Product of Umicore

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥99.95% metals basis

Names and Identifiers

• Pubchem Sid: 504764009
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764009
• Canonical Smiles: Ru.Ru.Ru.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+.C-#O+
• InChIKey: NQZFAUXPNWSLBI-UHFFFAOYSA-N
• INCHI: 1S/12CO.3Ru/c12*1-2
• Isomeric SMILES: [C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ru].[Ru].[Ru]
• WGK Germany: 3
• PubChem CID: 6096991
• Molecular Weight: 639.33
• Reaxy-Rn: 14281346

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Class Organic metal salts
      • Subclass Organic transition metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Class: Organic metal salts
• Subclass: Organic transition metal salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic transition metal salts
• Alternative Parents: Organic oxygen compounds Hydrocarbon derivatives Organic cations
• Molecular Framework: Not available
• Substituents: Organic transition metal salt - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic transition metal salts. These are organic salt compounds containing a transition metal atom in its ionic form.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Sparingly soluble in hydrocarbons (e.g. hexane, cyclohexane, benzene) and acetone.
• Melt Point(°C): 150°C
• Molecular Weight: 639.300 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 0
• Exact Mass: 642.654 Da
• Monoisotopic Mass: 641.652 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 10.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 15

XLogP3

References

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