Fig. 6: Parameters and results of optimization with ligands selected through descriptor clustering in campaign 2. | Communications Chemistry

Fig. 6: Parameters and results of optimization with ligands selected through descriptor clustering in campaign 2.

From: Data-science driven autonomous process optimization

Fig. 6

Conditions: 10 µmol 1-E, 1 µmol 1,3,5-trimethoxybenzene, 15 µmol (3-(benzyloxy)phenyl)boronic acid 3, 0.1–0.5 µmol Pd(ACN)2Cl2, 0.05–2 µmol L, 30 µmol K3PO4 (0.5 M aq) in ACN (0.05 M), 2 h at 10–40 °C. Tabulated results are provided in Supplementary Information Table SI-11. An animated chart of E-product yield over time is provided as Supplementary Movie 2.

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