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 C14H17N
Molecular Weight 199.29 g/mol
Exact Mass 199.1361 Da
InChI
InChI=1S/C14H17N/c1-14(2,3)12-6-8-13(9-7-12)15-10-4-5-11-15/h4-11H,1-3H3
InChIKey
QFYLEADXKNLMPJ-UHFFFAOYSA-N
SMILES
CC(C)(C)C1=CC=C(C=C1)N2C=CC=C2
Number of Atoms 32
Number of H-Bond Acceptors 1
Number of H-Bond Donors 0
Atoms in the Largest π-System 11
XLogP 3.8
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