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

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C15H17NO2
Molecular Weight 243.30 g/mol
Exact Mass 243.1259 Da
InChI
InChI=1S/C15H17NO2/c1-2-18-15(17)12-14(16-10-6-7-11-16)13-8-4-3-5-9-13/h3-11,14H,2,12H2,1H3
InChIKey
KYZZWDVULARGEL-UHFFFAOYSA-N
SMILES
CCOC(=O)CC(C1=CC=CC=C1)N2C=CC=C2
Number of Atoms 35
Number of H-Bond Acceptors 3
Number of H-Bond Donors 0
Atoms in the Largest π-System 6
XLogP 2.6
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