Hydrochloric Acid → Hydrochloric Acid

HRID 686417Notes

Reaction equation

HRID 686417 reaction equation
[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[Cl:22][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[c:28]1[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]1.[ClH:1].[F:2][c:3]1[cH:4][c:5]([CH:10]2[CH2:11][CH2:12][CH:13]([NH2:16])[CH2:14][CH2:15]2)[c:6]([CH3:9])[cH:7][cH:8]1.[H-:17].[I-:21].[K+:20].[K:19].[Na+:18]>>[ClH:1].[ClH:22].[F:2][c:3]1[cH:4][c:5]([CH:10]2[CH2:11][CH2:12][CH:13]([NH:16][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[c:28]3[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]3)[CH2:14][CH2:15]2)[c:6]([CH3:9])[cH:7][cH:8]1

Participants

11

Reactant 9

HCID 313Hydrochloric AcidHCID 813Potassium CationHCID 923Sodium ionHCID 6228DimethylformamideHCID 197503-(4-Fluorobenzoyl)propyl chlorideHCID 30165Iodide IonHCID 166653HydrideHCID 5462222PotassiumHCID 83262647HCID 83262647, compound

Product 2

HCID 313Hydrochloric Acid2×HCID 86733516HCID 86733516, compound

Sources & evidence

ORD record
ord-558218da8d104332ab1be778fe97218c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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