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 C18H13N
Molecular Weight 243.30 g/mol
Exact Mass 243.1048 Da
InChI
InChI=1S/C18H13N/c1-2-6-17-14(5-1)7-8-15-13-16(9-10-18(15)17)19-11-3-4-12-19/h1-13H
InChIKey
CFYUOKQBVSXUPG-UHFFFAOYSA-N
SMILES
C1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)N4C=CC=C4
Number of Atoms 32
Number of H-Bond Acceptors 1
Number of H-Bond Donors 0
Atoms in the Largest π-System 19
XLogP 4.3
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