Heterocycle-guided synthesis of m-hetarylanilines via three-component benzannulation

Andrey R. Galeev, Maksim V. Dmitriev, Alexander S. Novikov and Andrey N. Maslivets
Beilstein J. Org. Chem. 2024, 20, 2208–2216. https://doi.org/10.3762/bjoc.20.188

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C3H6O
Molecular Weight 58.08 g/mol
Exact Mass 58.0419 Da
InChI
InChI=1S/C3H6O/c1-3(2)4/h1-2H3
InChIKey
CSCPPACGZOOCGX-UHFFFAOYSA-N
SMILES
CC(=O)C
Number of Atoms 10
Number of H-Bond Acceptors 1
Number of H-Bond Donors 0
Atoms in the Largest π-System 1
XLogP 0.2
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