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 | C10H8N2O2 |
| Molecular Weight | 188.18 g/mol |
| Exact Mass | 188.0586 Da |
| InChI |
InChI=1S/C10H8N2O2/c13-12(14)10-5-3-9(4-6-10)11-7-1-2-8-11/h1-8H
|
| InChIKey |
PWCFKNYSCGRNRW-UHFFFAOYSA-N
|
| SMILES |
C1=CN(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]
|
| Number of Atoms | 22 |
| Number of H-Bond Acceptors | 1 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 14 |
| XLogP | 2.0 |