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Ensinger PEI

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Röchling Bis(cyclopentadienyl)zirconium chloride hydride (Schwartz's Reagent), 95%
Material Notes: Applications: Reagent for the hydrozirconation of olefins. Reagent for the hydrozirconation of alkynes. Catalyst for the hydroboration of olefins. Mediates the reduction of tertiary amides to aldehydes, without reduction of cyano, nitro, ester, or α,β-unsaturated groups. Catalyst for the asymmetric vinylation and dienylation of ketones. Useful reagent for dimethylzinc mediated additions alkenylzirconocenes to aldimines. Useful reagent for the synthesis of oxidized amides from nitriles. Reagent for the hydrozirconation of propargylic alcohols.

Synonyms: 37342-97-5; bis(cyclopentdienyl)zirconium(IV)chloride hydride; TR-015164; RTR-015164; FT-0696293

Smiles: [H-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Zr+4];

Information provided by Alfa Chemistry Materials.

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Physical PropertiesOriginal ValueComments
Molecular Weight 255.96 g/mol"Exact Mass" - Based on Specific Isotopes
 255.96 g/molMonoisotopic Mass - Isotopic Peak from Most Abundant Isotopes
 257.872 g/mol
Storage Temperature 2.00 - 8.00 °C
 
Descriptive Properties
Alfa Chemistry Materials CategoryPolymer Science
CAS Number37342-97-5
Complexity163
Covalently-Bonded Unit5
EC Number253-479-5
H-Bond Acceptor4
Heavy Atom Count12
InChIInChI=1S/2C5H5.ClH.Zr.H/c2*1-2-4-5-3-1;;;/h2*1-3H,4H2;1H;;/q2*-1;;+4;-1/p-1;
InChIKeyWIKZVPGVVYRJLQ-UHFFFAOYSA-M;
IUPAC Namecyclopenta-1,3-diene;hydride;zirconium(4+);chloride;
Molecular FormulaC10H11ClZr
Topological Polar Surface Area0A^2

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