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Clauson–Kaas pyrrole synthesis using diverse catalysts: a transition from conventional to greener approach

Dileep Kumar Singh and Rajesh Kumar

Beilstein J. Org. Chem. 2023, 19, 928–955. https://doi.org/10.3762/bjoc.19.71

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Chemical structure C<sub>10</sub>H<sub>9</sub>N<sub>3</sub>O<sub>2</sub>

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Extracted from

Scheme 9

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₀H₉N₃O₂
Molecular Weight	203.20 g/mol
Exact Mass	203.0695 Da
InChI	InChI=1S/C10H9N3O2/c11-9-4-3-8(7-10(9)13(14)15)12-5-1-2-6-12/h1-7H,11H2
InChIKey	SNQDIHJPOWWBNA-UHFFFAOYSA-N
SMILES	C1=CN(C=C1)C2=CC=C(C(=C2)[N+](=O)[O-])N
Number of Atoms	24
Number of H-Bond Acceptors	2
Number of H-Bond Donors	1
Atoms in the Largest π-System	15
XLogP	2.4

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