Bis(cyclopentadienyl)zirconium(IV) bis(trifluoromethanesulfonate)tetrahydrofuran complex

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Catalog Number
ACM89672775-1
Product Name
Bis(cyclopentadienyl)zirconium(IV) bis(trifluoromethanesulfonate)tetrahydrofuran complex
Structure
Structure
CAS
89672-77-5
Category
Heterocyclic Organic Compound
Synonyms
Zirconocene bis(trifluoromethanesulfonate), tetrahydrofuran adduct
Molecular Weight
591.7
Molecular Formula
C16H18F6O7S2Zr
Canonical SMILES
C1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+2]
InChI
InChI=1S/2C5H5.C4H8O.2CHF3O3S.Zr/c3*1-2-4-5-3-1;2*2-1(3,4)8(5,6)7;/h2*1-5H;1-4H2;2*(H,5,6,7);/q;+2/p-2
InChI Key
OFTAVORSNHLQHT-UHFFFAOYSA-L
Exact Mass
589.944513
Hydrogen Bond Acceptor Count
13
Hydrogen Bond Donor Count
0
Monoisotopic Mass
589.944513
Rotatable Bond Count
0
Topological Polar Surface Area
140 Ų
MSDS
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COA
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Spec Sheet
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