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 C6H11N
Molecular Weight 97.16 g/mol
Exact Mass 97.0891 Da
InChI
InChI=1S/C6H11N/c1-3-4-5-6-7-2/h3-6H2,1H3
InChIKey
QVUBMHTYZLUXSP-UHFFFAOYSA-N
SMILES
CCCCC[N+]#[C-]
Number of Atoms 18
Number of H-Bond Acceptors 0
Number of H-Bond Donors 0
Atoms in the Largest π-System 1
XLogP 1.7
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