Domino reactions of chromones with activated carbonyl compounds

Peter Langer
Beilstein J. Org. Chem. 2024, 20, 1256–1269. https://doi.org/10.3762/bjoc.20.108

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C19H13F5O7
Molecular Weight 448.30 g/mol
Exact Mass 448.0581 Da
InChI
InChI=1S/C19H13F5O7/c1-29-15(26)9-7-10-12(13(14(9)25)16(27)30-2)8-5-3-4-6-11(8)31-17(10,28)18(20,21)19(22,23)24/h3-7,25,28H,1-2H3
InChIKey
BNYOHXIZHNWPAL-UHFFFAOYSA-N
SMILES
COC(=O)C1=C(C(=C2C3=CC=CC=C3OC(C2=C1)(C(C(F)(F)F)(F)F)O)C(=O)OC)O
Number of Atoms 44
Number of H-Bond Acceptors 7
Number of H-Bond Donors 2
Atoms in the Largest π-System 20
XLogP 3.5
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