Hydrochloric Acid → Hydrochloric Acid

HRID 2310251Notes

Reaction equation

HRID 2310251 reaction equation
[CH2:39]1[CH2:40][O:41][CH2:42][CH2:43][NH:44]1.[CH3:51][CH2:52][O:53][C:54]([CH3:55])=[O:56].[Cl:1][CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][c:11]3[c:12]4[c:13]([n:14]([CH3:18])[c:15]3[cH:16][cH:17]2)[n:19]([CH3:32])[c:20](=[O:31])[c:21](-[c:23]2[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]2)[cH:22]4)[n:6][n:7]1[CH3:8].[ClH:45].[K+:33].[K+:34].[O-:35][C:36]([O-:37])=[O:38].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH2:57]>>[CH2:2]([c:3]1[cH:4][c:5](-[c:9]2[cH:10][c:11]3[c:12]4[c:13]([n:14]([CH3:18])[c:15]3[cH:16][cH:17]2)[n:19]([CH3:32])[c:20](=[O:31])[c:21](-[c:23]2[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]2)[cH:22]4)[n:6][n:7]1[CH3:8])[N:44]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[ClH:1]

Participants

10

Reactant 8

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 8083MorpholineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 66997926HCID 66997926, compound

Product 2

HCID 313Hydrochloric AcidHCID 66998715HCID 66998715, compound

Sources & evidence

ORD record
ord-4c51b42e4949446b972faea6b30483df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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