Bromide ion → HCID 10296372, compound

HRID 1135431Notes

Reaction equation

HRID 1135431 reaction equation
[Br-:36].[CH3:27][c:28]1[cH:29][c:30]([CH3:31])[c:32]([CH3:33])[cH:34][cH:35]1.[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][c:20]([S:23](=[O:24])(=[O:25])[CH3:26])[cH:21][cH:22]3)[cH:10][c:11]([C:15]#[N:16])[c:12](=[O:14])[nH:13]2)[cH:6][cH:7]1.[K+:37].[OH2:38]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][c:20]([S:23](=[O:24])(=[O:25])[CH3:26])[cH:21][cH:22]3)[cH:10][c:11]([C:15]#[N:16])[c:12]([Br:36])[n:13]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 259Bromide ionHCID 813Potassium CationHCID 962WaterHCID 72471,2,4-TrimethylbenzeneHCID 15408575HCID 15408575, compound

Product 1

HCID 10296372HCID 10296372, compound

Sources & evidence

ORD record
ord-f989e9645cff470fae721eebc95707aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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