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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>13</sub>N

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Extracted from

Scheme 20

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₂H₁₃N
Molecular Weight	171.24 g/mol
Exact Mass	171.1048 Da
InChI	InChI=1S/C12H13N/c1-2-6-12(7-3-1)8-11-13-9-4-5-10-13/h1-7,9-10H,8,11H2
InChIKey	KKCMGDGJMRZKJP-UHFFFAOYSA-N
SMILES	C1=CC=C(C=C1)CCN2C=CC=C2
Number of Atoms	26
Number of H-Bond Acceptors	1
Number of H-Bond Donors	0
Atoms in the Largest π-System	6
XLogP	2.8

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