Hydrochloric Acid → Hydrochloric Acid

HRID 1207722Notes

Reaction equation

HRID 1207722 reaction equation
[CH3:38][O-:39].[CH3:49][CH:50]([CH3:51])[CH2:52][C:53](=[O:54])[CH3:55].[Cl:2][CH2:3][CH2:4][c:5]1[c:6]([CH3:16])[n:7][c:8]2[n:9]([c:10]1=[O:11])[CH2:12][CH2:13][CH2:14][CH2:15]2.[ClH:17].[ClH:1].[F:18][c:19]1[cH:20][cH:21][c:22]([C:25](=[C:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:23][cH:24]1.[I-:48].[K+:47].[Na+:40].[Na+:41].[Na+:42].[O-:43][C:44](=[O:45])[O-:46]>>[CH2:3]([CH2:4][c:5]1[c:6]([CH3:16])[n:7][c:8]2[n:9]([c:10]1=[O:11])[CH2:12][CH2:13][CH2:14][CH2:15]2)[N:29]1[CH2:28][CH2:27][C:26](=[C:25]([c:22]2[cH:21][cH:20][c:19]([F:18])[cH:24][cH:23]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:31][CH2:30]1.[ClH:1].[ClH:2]

Participants

11

Reactant 9

HCID 313Hydrochloric Acid2×HCID 813Potassium CationHCID 923Sodium ion3×HCID 7909Methyl Isobutyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 27630793-(2-Chloroethyl)-2-methyl-6,7,8,9-tetrahydro-4hpyrido(1,2-a)pyrimidin-4-oneHCID 3826051MethoxideHCID 150203584-[(4-Fluorophenyl)(phenyl)methylidene]piperidine

Product 2

HCID 313Hydrochloric Acid2×HCID 13363388HCID 13363388, compound

Sources & evidence

ORD record
ord-02e49f7f37614550a850748c09942ac2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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