Bromide ion → Hydrochloric Acid

HRID 693587Notes

Reaction equation

HRID 693587 reaction equation
[Br-:38].[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][S:8][C:9]([CH3:12])([CH3:13])[C:10]1=[O:11].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:45][OH:46].[CH3:50][C:51]#[N:52].[Cl:47][CH2:48][Cl:49].[ClH:14].[I-:36].[K+:30].[K+:31].[Na+:37].[O-:32][C:33]([O-:34])=[O:35].[s:15]1[n:16][c:17]([N:24]2[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]2)[c:18]2[c:19]1[cH:20][cH:21][cH:22][cH:23]2>>[CH2:2]([CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][S:8][C:9]([CH3:12])([CH3:13])[C:10]1=[O:11])[N:27]1[CH2:26][CH2:25][N:24]([c:17]2[n:16][s:15][c:19]3[c:18]2[cH:23][cH:22][cH:21][cH:20]3)[CH2:29][CH2:28]1.[ClH:14]

Participants

14

Reactant 12

HCID 259Bromide ionHCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 887MethanolHCID 923Sodium ionHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 30165Iodide IonHCID 27721443-(1-Piperazinyl)-1,2-benzisothiazoleHCID 106117723-(4-Bromobutyl)-5,5-dimethyl-4-thiazolidinone

Product 2

HCID 313Hydrochloric AcidHCID 106689663-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-5,5-dimethyl-thiazolidin-4-one

Sources & evidence

ORD record
ord-87000ba12d864e49b4bdbc65ba3881e1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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