Hydrochloric Acid → HCID 86605886, compound

HRID 1217711Notes

Reaction equation

HRID 1217711 reaction equation
[C:50](=[O:51])([O-:52])[O-:53].[CH3:56][I:57].[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[CH3:64][CH2:65][OH:66].[CH:1](=[O:2])[c:3]1[c:4]([O:14][CH2:15][c:16]2[cH:17][c:18]([O:45][CH3:46])[c:19]([O:20][CH2:21][c:22]3[n:23][c:24](-[c:28]4[cH:29][cH:30][c:31]([O:38][S:39]([CH3:40])(=[O:41])=[O:42])[c:32]([C:33](=[O:34])[O:35][CH3:36])[cH:37]4)[o:25][c:26]3[CH3:27])[cH:43][cH:44]2)[n:5][n:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[cH:7]1.[ClH:49].[K+:54].[K+:55].[Na+:48].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1.[OH-:47].[OH2:58]>>[CH:1](=[O:2])[c:3]1[c:4]([O:14][CH2:15][c:16]2[cH:17][c:18]([O:45][CH3:46])[c:19]([O:20][CH2:21][c:22]3[n:23][c:24](-[c:28]4[cH:29][cH:30][c:31]([O:38][CH3:50])[c:32]([C:33](=[O:34])[O:35][CH3:36])[cH:37]4)[o:25][c:26]3[CH3:27])[cH:43][cH:44]2)[n:5][n:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[cH:7]1

Participants

12

Reactant 11

HCID 313Hydrochloric AcidHCID 702EthanolHCID 813Potassium Cation2×HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 6328Methyl iodideHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 86605885HCID 86605885, compound

Product 1

HCID 86605886HCID 86605886, compound

Sources & evidence

ORD record
ord-76f620f0ab0c4299abad613065cf1ff6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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