(6-Cumene)(5-cyclopentadienyl)iron(II) hexafluorophosphate

Base Information

• Chemical Name: (6-Cumene)(5-cyclopentadienyl)iron(II) hexafluorophosphate
• CAS No.: 32760-80-8
• Deprecated CAS: 114558-86-0,133832-04-9,34978-88-6
• Molecular Formula: C14H17FePF6
• Molecular Weight: 386.1
• Mol file: 32760-80-8.mol

Synonyms:32760-80-8;cumene;cyclopenta-1,3-diene;iron(2+);hexafluorophosphate;(6-Cumene)(5-cyclopentadienyl)iron(II) hexafluorophosphate;Iron(1+), (.eta.5-2,4-cyclopentadien-1-yl)(1,2,3,4,5,6-.eta.)-(1-methylethyl)benzene-, hexafluoropho;DTXSID9052008

Chemical Property of (6-Cumene)(5-cyclopentadienyl)iron(II) hexafluorophosphate

Chemical Property:

• Melting Point: 269℃
• PSA: 13.59000
• LogP: 6.47760
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 386.032142
• Heavy Atom Count: 22
• Complexity: 154

Purity/Quality:

99.9% ^*data from raw suppliers

(6-CUMENE)(5-CYCLOPENTADIENYL)IRON(II) HEXAFLUOROPHOSPHATE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 52/53
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=CC=C1.[CH-]1C=CC=C1.F[P-](F)(F)(F)(F)F.[Fe+2]

Technology Process of (6-Cumene)(5-cyclopentadienyl)iron(II) hexafluorophosphate

There total 2 articles about (6-Cumene)(5-cyclopentadienyl)iron(II) 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: 50.0%

hexafluorophosphoric acid + {(Cp)iron(II)(η5-C6H5(isopropyl)O)}2 → (η6-cumene)(η5-cyclopentadienyl)iron hexafluorophosphate (32760-80-8)

Guidance literature:

In diethyl ether; byproducts: H2O2; The dimeric peroxide complex is hydrolyzed by HPF6 at -80°C under dry N2.; characterization by (1)H NMR;

Reference yield:

sodium hexaflorophosphate + {(Cp)iron(I)(η6-isopropylbenzene)} (98162-09-5) → sodium peroxide + (η6-cumene)(η5-cyclopentadienyl)iron hexafluorophosphate (32760-80-8)

Guidance literature:

With oxygen; In tetrahydrofuran; addn. of O2 at -80°C under dry N2;

upstream raw materials:

{(Cp)iron(I)(η6-isopropylbenzene)}

Refernces