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 | C13H15NO |
| Molecular Weight | 201.26 g/mol |
| Exact Mass | 201.1154 Da |
| InChI |
InChI=1S/C13H15NO/c1-11(14-9-5-6-10-14)13(15)12-7-3-2-4-8-12/h2-11,13,15H,1H3/t11-,13-/m0/s1
|
| InChIKey |
MVXNDYYEUYJEMS-AAEUAGOBSA-N
|
| SMILES |
C[C@@H]([C@@H](C1=CC=CC=C1)O)N2C=CC=C2
|
| Number of Atoms | 30 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 6 |
| XLogP | 2.1 |