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 C7H11NO
Molecular Weight 125.17 g/mol
Exact Mass 125.0841 Da
InChI
InChI=1S/C7H11NO/c9-7-3-6-8-4-1-2-5-8/h1-2,4-5,9H,3,6-7H2
InChIKey
ORCXGLCMROHGOM-UHFFFAOYSA-N
SMILES
C1=CN(C=C1)CCCO
Number of Atoms 20
Number of H-Bond Acceptors 2
Number of H-Bond Donors 1
Atoms in the Largest π-System 5
XLogP 0.8
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