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Toluene → 2-Butylcyclopenta-1,3-diene;zirconium(4+);dichloride

HRID 1952391
Notes
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Reaction equation

HRID 1952391 reaction equation
C1(C)C=CC=CC=1.[Cl-:8].[Cl-].[CH2:10]([C:14]1([Zr+2:19]C2(CCCC)C=CC=C2)[CH:18]=[CH:17][CH:16]=[CH:15]1)[CH2:11][CH2:12][CH3:13].C=C>CO>[CH3:13][CH2:12][CH2:11][CH2:10][C:14]1[CH:15]=[CH:16][CH2:17][C-:18]=1.[CH3:13][CH2:12][CH2:11][CH2:10][C:14]1[CH:15]=[CH:16][CH2:17][C-:18]=1.[Cl-:8].[Cl-:8].[Zr+4:19]
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 3

HCID 1140Toluene3×HCID 6325Ethylene2×HCID 178442027HCID 178442027, compound

Product 1

HCID 212257222-Butylcyclopenta-1,3-diene;zirconium(4+);dichloride

Reagents, catalysts & solvents 1

HCID 887MethanolSolvent

Conditions

Temperature
40 °C

Procedure

To a 500 mL four-necked flask equipped with magnetic stirrer was charged 250 mL of toluene. The toluene was heated to 34° C. To this was added a toluene solution of 0.043 g (1.6 mmol) of polymethylaluminoxane composition based on aluminum atoms. Bis(n-butylcyclopentadienyl)zirconium dichloride ((nBu-Cp)2ZrCl2) was added to achieve an Al/Zr mole ratio of 5,000. While raising the temperature to 40° C., ethylene gas was blown in. After 10 minutes, the ethylene gas feed was halted and methanol was introduced to deactivate the catalyst. The polyethylene produced was filtered and dried. The polymerization activity was calculated to be 35×106 g-PE/mol-Zr·atm·hr.

Workup

  1. customTo a 500 mL four-necked flask equipped with magnetic stirrer

Sources & evidence

ORD record
ord-05c0e5419f19417189bce0cdfe4f9a9d
Source dataset
uspto-grants-2013_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08404880B2

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes