Sodium ion → HCID 19887357, compound

HRID 1137290Notes

Reaction equation

HRID 1137290 reaction equation
[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[CH:9][CH2:10][CH2:11][N:12]2[CH2:13][CH2:14][C:15]3([C:16]([CH3:27])([OH:28])[N:17]([CH:21]4[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]4)[C:18](=[O:20])[O:19]3)[CH2:29][CH2:30]2)[c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:6][cH:7]1.[Na+:51].[OH-:50].[OH2:38].[c:39]1([CH3:40])[cH:41][cH:42][c:43]([S:44]([OH:45])(=[O:46])=[O:47])[cH:48][cH:49]1.[c:52]1([CH3:53])[c:54]([CH3:55])[cH:56][cH:57][cH:58][cH:59]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[CH:9][CH2:10][CH2:11][N:12]2[CH2:13][CH2:14][C:15]3([C:16](=[CH2:27])[N:17]([CH:21]4[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]4)[C:18](=[O:20])[O:19]3)[CH2:29][CH2:30]2)[c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 7237O-XyleneHCID 19887346HCID 19887346, compound

Product 1

HCID 19887357HCID 19887357, compound

Sources & evidence

ORD record
ord-4f87b709f6714452af3bafda33d522bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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