Sodium ion → HCID 178504998, compound

HRID 2152464Notes

Reaction equation

HRID 2152464 reaction equation
[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[Cl:59][CH2:60][Cl:61].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([C:33]([c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)([c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[cH:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]3[n:17]([cH:18]2)[c:19](-[c:22]2[cH:23][cH:24][c:25]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:26][cH:27]2)[cH:20][n:21]3)[cH:6][cH:7]1.[Na+:63].[OH-:62].[OH2:64].[OH:52][C:53]([C:54]([F:55])([F:56])[F:57])=[O:58]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][nH:10][cH:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]3[n:17]([cH:18]2)[c:19](-[c:22]2[cH:23][cH:24][c:25]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:26][cH:27]2)[cH:20][n:21]3)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 22031841HCID 22031841, compound

Product 1

HCID 178504998HCID 178504998, compound

Sources & evidence

ORD record
ord-9da4af6d495b413d8951633b5acac105
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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