The Groebke–Blackburn–Bienaymé reaction in its maturity: innovation and improvements since its 21st birthday (2019–2023)
Cristina Martini, Muhammad Idham Darussalam Mardjan and Andrea Basso
Beilstein J. Org. Chem. 2024, 20, 1839–1879.
https://doi.org/10.3762/bjoc.20.162
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C4H6N2 |
| Molecular Weight | 82.10 g/mol |
| Exact Mass | 82.0531 Da |
| InChI |
InChI=1S/C4H6N2/c1-6-3-2-5-4-6/h2-4H,1H3
|
| InChIKey |
MCTWTZJPVLRJOU-UHFFFAOYSA-N
|
| SMILES |
CN1C=CN=C1
|
| Number of Atoms | 12 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 5 |
| XLogP | 0.3 |