COBALTOCENE HEXAFLUOROPHOSPHATE

Base Information

• Chemical Name: COBALTOCENE HEXAFLUOROPHOSPHATE
• CAS No.: 12427-42-8
• Molecular Formula: C11H14CoF6P
• Molecular Weight: 334.147
• European Community (EC) Number: 235-655-3
• Mol file: 12427-42-8.mol

Synonyms:COBALTICINIUM HEXAFLUOROPHOSPHATE;COBALTOCENE HEXAFLUOROPHOSPHATE;COBALTOCENIUM HEXAFLUOROPHOSPHATE;BIS(CYCLOPENTADIENYL)COBALT HEXAFLUOROPHOSPHATE;BIS(CYCLOPENTADIENYL)COBALT(III) HEXAFLUOROPHOSPHATE;cobaltocenium hexafluorophosphate(1-);BIS(CYCLOPENTADIENYL)COBALT(III);Cobalticiniumhexafluorophosphate,98%

Chemical Property of COBALTOCENE HEXAFLUOROPHOSPHATE

Chemical Property:

• Appearance/Colour: yellow powder
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 13.59000
• Density: g/cm³
• LogP: 5.42540
• Solubility.: slightly sol. in Dimethylformamide
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 0
• Exact Mass: 350.006925
• Heavy Atom Count: 19
• Complexity: 116

Purity/Quality:

98%,99%, ^*data from raw suppliers

Bis(cyclopentadienyl)cobalt(III) Hexafluorophosphate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C.[CH-]1C=CC=C1.[CH-]1C=CC=C1.F[P-](F)(F)(F)(F)F.[Co+3]
• Uses: Uses:Cocatalyst for Heck reaction of aryl iodides with alkenes using palladium as catalyst in waterReactant for modification of organometallic electrodes surfaces through cathodic reductionReactant in synthesis and solution self-assembly of side-chain cobaltocenium-containing block copolymers

Technology Process of COBALTOCENE HEXAFLUOROPHOSPHATE

There total 24 articles about COBALTOCENE HEXAFLUOROPHOSPHATE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

cobaltocene (1277-43-6,78206-33-4) + {(C5(CH3)5)3Ir3S2}(2+)*2PF6(1-)={(C5(CH3)5)3Ir3S2}(PF6)2 → bis(cyclopentadienyl)cobalt(III) hexafluorophosphate (12427-42-8) + [(Ir(η(5)-C5Me5))3(μ3-S)2]

Guidance literature:

In acetonitrile; a soln. of the starting Ir-complex in MeCN is added via cannula to a soln. of cobaltocene in MeCN; after 2 h the solvent is removed in vac., the residue is extd., filtd., evaod. to dryness, the powder is heated at 40°C (1 mmHg) for 4 h, elem. anal.;

DOI:10.1021/ja00090a030

Reference yield: 95.0%

cobaltocene (1277-43-6,78206-33-4) + [MoW(C43H50N4)2](1+)*PF6(1-)=[MoW(C43H50N4)2](PF6) → bis(cyclopentadienyl)cobalt(III) hexafluorophosphate (12427-42-8) + [MoW(C36H44N4)2]

Guidance literature:

In benzene; Co-compd. soln. addn. dropwise to stirred MoW-compd. supn., soln. stirring for 2 h, filtration (removal of Co(C5H5)2(PF6)), solvent removal (vac.); sublimation of unreacted cobaltocene; vac. drying (0.01 Torr, 4 h);

DOI:10.1021/ja972130m

Reference yield: 80.0%

cobaltocene (1277-43-6,78206-33-4) + {Re2(μ-SO2)(μ-Cl)Cl2(CS)(μ-diphenylphosphinomethane)2(CO)}PF6 → bis(cyclopentadienyl)cobalt(III) hexafluorophosphate (12427-42-8) + {Re2(μ-SO2)(μ-Cl)Cl2(CS)(μ-diphenylphosphinomethane)2(CO)}PF6

Guidance literature:

In acetone; equimolar amounts; room temp.; 1 h;; filtered; washed with acetone and Et2O; vacuum dried; elem. anal.;;

DOI:10.1016/S0277-5387(00)81660-5

upstream raw materials:

dicarbonylcyclopentadienylcobalt

3-Chloro-2-methylpropene

cyclopenta-1,3-diene

methylcyclopentadiene

Downstream raw materials:

cobaltocene

{Co(C₅H₅)2}⁽¹⁺⁾*{PF₆(Al(CH₃)3)6}^(1-)*15.4C₆H₅CH₃={Co(C₅H₅)2}{PF₆(Al(CH₃)3)6}*15.4C₆H₅CH₃

C₂F₆NO₄S₂^(1-)*C₁₀H₁₀Co⁽¹⁺⁾

Refernces

• 1、 Zhu, Tianyu,Sha, Ye,Firouzjaie, Horie Adabi,Peng, Xiong,Cha, Yujin,Dissanayake, D. M. M. Mevan,Smith, Mark D.,Vannucci, Aaron K.,Mustain, William E.,Tang, Chuanbing. "Rational Synthesis of Metallo-Cations Toward Redox- A nd Alkaline-Stable Metallo-Polyelectrolytes". . p. 1083 - 1089. Retrieved 2020.
• 2、 Funaioli, Tiziana,Leoni, Piero,Marchetti, Lorella,Albinati, Alberto,Rizzato, Silvia,Fabrizi De Biani, Fabrizia,Ienco, Andrea,Manca, Gabriele,Mealli, Carlo. "Unprecedented tris-phosphido-bridged triangular clusters with 42 valence electrons. chemical, electrochemical and computational studies of their formation and stability". . p. 4635 - 4647. Retrieved 2013.
• 3、 Ren, Lixia,Hardy, Christopher G.,Tang, Chuanbing. "Synthesis and solution self-assembly of side-chain cobaltocenium-containing block copolymers". . p. 8874 - 8875. Retrieved 2010.
• 4、 Fourie, Eleanor,Van Rensburg, J. Marthinus Janse,Swarts, Jannie C.. "Synthesis, crystal structure and comparative electrochemistry of metallocenyldiphenylphosphines of ruthenocene, osmocene, ferrocene and cobaltocenium hexafluorophosphate". . p. 80 - 87. Retrieved 2014/02/14.