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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

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Chemical structure C<sub>5</sub>H<sub>13</sub>NO<sub>2</sub>

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Extracted from

Scheme 29 Scheme 70

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₅H₁₃NO₂
Molecular Weight	119.16 g/mol
Exact Mass	119.0946 Da
InChI	InChI=1S/C5H13NO2/c1-6(2)5(7-3)8-4/h5H,1-4H3
InChIKey	ZSXGLVDWWRXATF-UHFFFAOYSA-N
SMILES	CN(C)C(OC)OC
Number of Atoms	21
Number of H-Bond Acceptors	3
Number of H-Bond Donors	0
Atoms in the Largest π-System	0
XLogP	0.0

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