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Chiral DES database
Version 11 2024-04-22, 19:41
Version 10 2024-03-28, 16:03
Version 9 2023-08-15, 22:05
Version 8 2023-08-15, 22:03
Version 7 2023-07-31, 13:55
Version 6 2023-07-26, 19:12
Version 5 2023-07-24, 20:18
Version 4 2023-07-24, 20:14
Version 3 2022-07-19, 17:38
Version 2 2022-06-17, 14:35
Version 1 2022-04-08, 22:54
dataset
posted on 2024-04-22, 19:41 authored by Todd HopkinsTodd Hopkins, Liam VandenElzen, Brian P. Nelson, Vishnu Vaid, Jayme Brickley, Paola Ariza, Grace Whitacre, Inaya Patel, Olivia Gooch, Charlotte Jordan, Mandy BechmanThis is a database of mixtures of hydrogen bond acceptors (HBA) and chiral hydrogen bond donors (HBD) to screen for potential deep eutectic solvent (DES) formation. Mole ratios of HBA-HBD were mixed and heated to 55 C for ~ 2 hours. The mixtures were then allowed to cool to 20 C. The results are recorded in the database as yes (liquid), no (solid), or partial (mostly liquid with some solid). All HBA and HBDs are entered by chemical name and by isomeric SMILES.
Latest uploaded version (32824) is the same database as the previous version (72423), but has an added search function on a second tab. If you are looking for a CSV version of the database use Chiral DES Database-72423.csv.
