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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>12</sub>H<sub>11</sub>NO

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Extracted from

Scheme 30 Scheme 31

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₂H₁₁NO
Molecular Weight	185.22 g/mol
Exact Mass	185.0841 Da
InChI	InChI=1S/C12H11NO/c1-10(14)11-5-4-6-12(9-11)13-7-2-3-8-13/h2-9H,1H3
InChIKey	YCPWTIWLOFQEJJ-UHFFFAOYSA-N
SMILES	CC(=O)C1=CC=CC(=C1)N2C=CC=C2
Number of Atoms	25
Number of H-Bond Acceptors	2
Number of H-Bond Donors	0
Atoms in the Largest π-System	13
XLogP	1.6

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