Sodium ion → HCID 178504677, compound

HRID 97898Notes

Reaction equation

HRID 97898 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:10]2[cH:11][cH:12][n:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:44]([F:45])([F:46])[F:47])[n:22][n:23]([C:25]([c:26]5[cH:27][cH:28][cH:29][cH:30][cH:31]5)([c:32]5[cH:33][cH:34][cH:35][cH:36][cH:37]5)[c:38]5[cH:39][cH:40][cH:41][cH:42][cH:43]5)[cH:24]4)[cH:18][c:19]23)[s:9]1.[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[Cl:55][CH2:56][Cl:57].[Na+:59].[OH-:58].[OH2:60].[OH:48][C:49]([C:50]([F:51])([F:52])[F:53])=[O:54]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:10]2[cH:11][cH:12][n:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:44]([F:45])([F:46])[F:47])[n:22][nH:23][cH:24]4)[cH:18][c:19]23)[s:9]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 22031472HCID 22031472, compound

Product 1

HCID 178504677HCID 178504677, compound

Sources & evidence

ORD record
ord-65272894d0f14bce8f1f276d034dff4f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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