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 C10H8N2
Molecular Weight 156.18 g/mol
Exact Mass 156.0687 Da
InChI
InChI=1S/C10H8N2/c1-11-7-9-3-5-10(6-4-9)8-12-2/h3-6H,7-8H2
InChIKey
PUQNAXJFMTUAPI-UHFFFAOYSA-N
SMILES
[C-]#[N+]CC1=CC=C(C=C1)C[N+]#[C-]
Number of Atoms 20
Number of H-Bond Acceptors 0
Number of H-Bond Donors 0
Atoms in the Largest π-System 6
XLogP -1.0
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