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Neodymium(III) trifluoromethanesulfonate

Catalog Number
ACM34622087
Product Name
Neodymium(III) trifluoromethanesulfonate
Structure
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CAS
34622-08-7
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Synonyms
Neodymium(III) triflate
IUPAC Name
neodymium(3+);trifluoromethanesulfonate;
Molecular Weight
591.5
Molecular Formula
C3F9NdO9S3
Canonical SMILES
C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Nd+3]
InChI
InChI=1S/3CHF3O3S.Nd/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;+3/p-3
InChI Key
WYRSPTDNOIZOGA-UHFFFAOYSA-K
Purity
98%
Appearance
Powder
Complexity
145
Covalently-Bonded Unit Count
4
Defined Atom Stereocenter Count
0
Exact Mass
588.7638
H-Bond Acceptor
18
Heavy Atom Count
25
Monoisotopic Mass
588.7638
Rotatable Bond Count
0
Topological Polar Surface Area
197 Ų
Application
Neodymium(III) trifluoromethanesulfonate, presented as a light purple crystalline powder, serves a diverse range of purposes in various chemical reactions. It is effectively utilized in the Aldol reaction of silyl enol ethers with aldehydes and plays a crucial role as a catalyst in the dehydration of fructose. This compound also facilitates Diels-Alder reactions involving cyclopentadiene and alkyl acrylates, as well as α-amination reactions of pyrazolones. Furthermore, it is instrumental in the polymerization of cyclosiloxanes, the direct polycondensation of dicarboxylic acids and diols, and the regioselective reductive ring opening of benzylidene acetals. Additionally, Neodymium(III) trifluoromethanesulfonate is employed in Paal-Knorr cyclocondensation and the nitration of benzene, making it a versatile catalyst in numerous synthetic organic processes.
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