Bis(cycloocta-1,5-diene)rhodium(I) hexafluorophosphate - ≥98% , CAS No.62793-31-1

CAS: 62793-31-1 Cat. No.: B589714 Molecular Weight: 464.23 PubChem CID: 10994226

GRADE & PURITY ≥98%

Synonyms

[rh(cod)2]pf6 | Bis(cycloocta-1,5-diene)rhodium(I) hexafluorophosphate | MolPort-027-836-914 | -rhodium(1+) bis((1Z,5Z)-cycloocta-1,5-diene) hexafluoro--phosphanuide | (1Z,5Z)-cycloocta-1,5-diene;rhodium;hexafluorophosphate | DTXSID70451106

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

[rh(cod)2]pf6 | Bis(cycloocta-1, 5-diene)rhodium(I) hexafluorophosphate | MolPort-027-836-914 | -rhodium(1+) bis((1Z, 5Z)-cycloocta-1, 5-diene) hexafluoro--phosphanuide | (1Z, 5Z)-cycloocta-1, 5-diene;rhodium;hexafluorophosphate | DTXSID70451106

Specifications & Purity

≥98%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1CC=CCCC=C1.C1CC=CCCC=C1.F[P-](F)(F)(F)(F)F.[Rh]
• IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene;rhodium;hexafluorophosphate
• InChIKey: LPYLNJHERBLCRN-QMDOQEJBSA-N
• INCHI: 1S/2C8H12.F6P.Rh/c2*1-2-4-6-8-7-5-3-1;1-7(2,3,4,5)6;/h2*1-2,7-8H,3-6H2;;/q;;-1;/b2*2-1-,8-7-
• Isomeric SMILES: C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.F[P-](F)(F)(F)(F)F.[Rh]
• PubChem CID: 10994226
• Molecular Weight: 464.23

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Class Unsaturated hydrocarbons
      • Subclass Olefins
        • Level5 Cyclic olefins
          • Level6 Cycloalkenes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Unsaturated hydrocarbons
• Subclass: Olefins
• Intermediate Tree Nodes: Cyclic olefins
• Direct Parent: Cycloalkenes
• Alternative Parents: Organic transition metal salts Unsaturated aliphatic hydrocarbons Hydrocarbon derivatives Organic anions
• Molecular Framework: Not available
• Substituents: Organic transition metal salt - Cycloalkene - Unsaturated aliphatic hydrocarbon - Hydrocarbon derivative - Organic anion - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as cycloalkenes. These are unsaturated monocyclic hydrocarbons having one endocyclic double bond.
• 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

• Molecular Weight: 464.230 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 0
• Exact Mass: 464.057 Da
• Monoisotopic Mass: 464.057 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 24
• Formal Charge: -1
• Complexity: 135.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 4
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 4
• Covalently-Bonded Unit Count: 4

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