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 C4H4N4
Molecular Weight 108.10 g/mol
Exact Mass 108.0436 Da
InChI
InChI=1S/C4H4N4/c5-1-3-4(6)8-2-7-3/h2H,6H2,(H,7,8)
InChIKey
XEPBRDBFOSKYCF-UHFFFAOYSA-N
SMILES
C(#N)C1=C(N)N=CN1
Number of Atoms 12
Number of H-Bond Acceptors 4
Number of H-Bond Donors 2
Atoms in the Largest π-System 8
XLogP -0.6
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