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 C18H14N2
Molecular Weight 258.32 g/mol
Exact Mass 258.1157 Da
InChI
InChI=1S/C18H14N2/c1-2-12-19(11-1)17-9-5-8-16-15(17)7-6-10-18(16)20-13-3-4-14-20/h1-14H
InChIKey
GGNGEHCPRJVSPP-UHFFFAOYSA-N
SMILES
C1=CN(C=C1)C2=C3C=CC=C(C3=CC=C2)N4C=CC=C4
Number of Atoms 34
Number of H-Bond Acceptors 2
Number of H-Bond Donors 0
Atoms in the Largest π-System 20
XLogP 3.1
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