Multicomponent syntheses of pyrazoles via (3 + 2)-cyclocondensation and (3 + 2)-cycloaddition key steps

Ignaz Betcke, Alissa C. Götzinger, Maryna M. Kornet and Thomas J. J. Müller
Beilstein J. Org. Chem. 2024, 20, 2024–2077. https://doi.org/10.3762/bjoc.20.178

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C14H27FSn
Molecular Weight 333.07 g/mol
Exact Mass 334.1119 Da
InChI
InChI=1S/3C4H9.C2F.Sn/c3*1-3-4-2;1-2-3;/h3*1,3-4H2,2H3;;
InChIKey
BKHMFBHGZJDUAW-UHFFFAOYSA-N
SMILES
CCCC[Sn](CCCC)(CCCC)C#CF
Number of Atoms 43
Number of H-Bond Acceptors 0
Number of H-Bond Donors 0
Atoms in the Largest π-System 2
XLogP 6.3
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