Sodium ion → HCID 86644406, compound

HRID 1151782Notes

Reaction equation

HRID 1151782 reaction equation
[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[F:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]([CH2:22][N:23]([C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH3:31])[s:11][c:12]2[S:13][c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][cH:19]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:48].[Na+:49].[OH:32][O:33][C:34]([c:35]1[cH:36][c:37]([Cl:38])[cH:39][cH:40][cH:41]1)=[O:42].[S:43]([O-:44])([O-:45])(=[O:46])=[S:47]>>[F:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]([CH2:22][N:23]([C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH3:31])[s:11][c:12]2[S:13]([c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][cH:19]2)=[O:32])[cH:4][cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 1084Thiosulfate ionHCID 8857Ethyl AcetateHCID 70297m-Chloroperbenzoic acidHCID 86644405HCID 86644405, compound

Product 1

HCID 86644406HCID 86644406, compound

Sources & evidence

ORD record
ord-c66258075e77440f87d2e1384a0f8903
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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