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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>13</sub>H<sub>15</sub>NO<sub>2</sub>

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Extracted from

Scheme 34

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₃H₁₅NO₂
Molecular Weight	217.26 g/mol
Exact Mass	217.1103 Da
InChI	InChI=1S/C13H15NO2/c15-10-12(14-8-4-5-9-14)13(16)11-6-2-1-3-7-11/h1-9,12-13,15-16H,10H2/t12-,13-/m0/s1
InChIKey	YFADPEDPBPIKHA-STQMWFEESA-N
SMILES	C1=CC=C(C=C1)[C@@H]([C@H](CO)N2C=CC=C2)O
Number of Atoms	31
Number of H-Bond Acceptors	3
Number of H-Bond Donors	2
Atoms in the Largest π-System	6
XLogP	0.9

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