Acetone → HCID 178449972, compound

HRID 681046Notes

Reaction equation

HRID 681046 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[c:10](-[c:15]2[cH:16][c:17]3[c:18]([nH:19][c:20]([CH2:22][Cl:23])[n:21]3)[cH:24][cH:25]2)[cH:11][cH:12][cH:13][cH:14]1.[C:37](=[O:38])([O-:39])[O-:40].[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][C:50](=[O:51])[CH3:52].[Cs+:47].[Cs+:48].[F:26][C:27]([c:28]1[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]1)([F:35])[F:36].[Na+:41].[Na+:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[c:10](-[c:15]2[cH:16][c:17]3[c:18]([nH:19][c:20]([CH2:22][O:34][c:31]4[cH:30][cH:29][c:28]([C:27]([F:26])([F:35])[F:36])[cH:33][cH:32]4)[n:21]3)[cH:24][cH:25]2)[cH:11][cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 923Sodium ion2×HCID 19660Carbonate Ion2×HCID 678744-(Trifluoromethyl)phenolHCID 104967Cesium cation2×HCID 178449971HCID 178449971, compound

Product 1

HCID 178449972HCID 178449972, compound

Sources & evidence

ORD record
ord-57a7938ef31445f6ad8f28a8140167f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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