Hydrochloric Acid → HCID 22136366, compound

HRID 693119Notes

Reaction equation

HRID 693119 reaction equation
[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([NH2:7])[CH3:8])=[O:9].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[CH3:56][CH2:57][CH2:58][CH2:59][CH2:60][CH3:61].[CH:46]([Cl:47])([Cl:48])[Cl:49].[Cl:36][CH2:37][Cl:38].[ClH:1].[F:18][c:19]1[c:20]([N+:26](=[O:27])[O-:28])[cH:21][c:22]([F:25])[cH:23][cH:24]1.[Mg+2:12].[Na+:11].[O-:13][S:14]([O-:15])(=[O:16])=[O:17].[OH-:10]>>[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([NH:7][c:19]1[c:20]([N+:26](=[O:27])[O-:28])[cH:21][c:22]([F:25])[cH:23][cH:24]1)[CH3:8])=[O:9]

Participants

14

Reactant 13

HCID 313Hydrochloric AcidHCID 888Magnesium CationHCID 923Sodium ionHCID 961HydroxideHCID 1117Sulfate IonHCID 1140TolueneHCID 6212ChloroformHCID 6344DichloromethaneHCID 8058HexaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 677672,5-DifluoronitrobenzeneHCID 69236NoName_3047

Product 1

HCID 22136366HCID 22136366, compound

Sources & evidence

ORD record
ord-8e9050476d8047ccb4b60393c4836725
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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