Hydrochloric Acid → Hydrochloric Acid

HRID 177415Notes

Reaction equation

HRID 177415 reaction equation
[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[CH3:43][CH2:44][O:45][CH2:46][CH3:47].[CH:32]([N:33]([CH3:34])[CH3:35])=[O:36].[Cl:22][CH2:23][CH2:24][N:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1.[ClH:21].[ClH:31].[H-:19].[Na+:20].[OH2:48].[c:1]1([C:7](=[N:8][OH:9])[c:10]2[cH:11][c:12]3[c:13]([cH:14][n:15][cH:16][cH:17]3)[nH:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[ClH:22].[c:1]1([C:7](=[N:8][O:9][CH2:23][CH2:24][N:25]2[CH2:26][CH2:27][O:28][CH2:29][CH2:30]2)[c:10]2[cH:11][c:12]3[c:13]([cH:14][n:15][cH:16][cH:17]3)[nH:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

11

Reactant 9

HCID 313Hydrochloric Acid2×HCID 923Sodium ionHCID 962WaterHCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 767274-(2-Chloroethyl)morpholineHCID 166653HydrideHCID 136386495HCID 136386495, compound

Product 2

HCID 313Hydrochloric AcidHCID 136366034HCID 136366034, compound

Sources & evidence

ORD record
ord-377bd15bdb5345fd857dc9b78fab569e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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