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 | C8H11NO3 |
| Molecular Weight | 169.18 g/mol |
| Exact Mass | 169.0739 Da |
| InChI |
InChI=1S/C8H11NO3/c1-12-8(11)7(6-10)9-4-2-3-5-9/h2-5,7,10H,6H2,1H3/t7-/m0/s1
|
| InChIKey |
OIPXAMLFTNJIOA-ZETCQYMHSA-N
|
| SMILES |
COC(=O)[C@H](CO)N1C=CC=C1
|
| Number of Atoms | 23 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 5 |
| XLogP | 0.2 |