Hydrochloric Acid → HCID 59864777, compound

HRID 2342923Notes

Reaction equation

HRID 2342923 reaction equation
[CH3:47][S:48]([CH3:49])=[O:50].[Cl:17][c:18]1[cH:19][c:20]([CH2:25][C:26](=[O:27])[OH:28])[cH:21][cH:22][c:23]1[OH:24].[ClH:52].[F-:15].[F:1][c:2]1[c:3]([N+:12](=[O:13])[O-:14])[c:4]2[c:5]([nH:6][c:7]([CH3:9])[n:8]2)[cH:10][cH:11]1.[K+:16].[O:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37][O:38][CH2:39][CH2:40][O:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH2:51]>>[c:2]1([O:24][c:23]2[c:18]([Cl:17])[cH:19][c:20]([CH2:25][C:26](=[O:27])[OH:28])[cH:21][cH:22]2)[c:3]([N+:12](=[O:13])[O-:14])[c:4]2[c:5]([nH:6][c:7]([CH3:9])[n:8]2)[cH:10][cH:11]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 813Potassium CationHCID 962WaterHCID 28179Fluoride IonHCID 2855718-Crown-6HCID 1185343-Chloro-4-hydroxyphenylacetic acidHCID 54016193HCID 54016193, compound

Product 1

HCID 59864777HCID 59864777, compound

Sources & evidence

ORD record
ord-229f0cfc152042dd8e36d8935b6d2c28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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