Hydrochloric Acid → Hydrochloric Acid

HRID 286907Notes

Reaction equation

HRID 286907 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][cH:8][c:9]2[c:10]1[NH:11][C:12]1=[C:17]([C:16](=[O:38])[CH2:15][N:14]([O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[CH2:13]1)[CH:18]2[c:19]1[o:20][c:21]([S:24][c:25]2[n:26][c:27]3[c:28]([nH:29]2)[cH:30][cH:31][c:32]([O:34][CH:35]([F:36])[F:37])[cH:33]3)[cH:22][cH:23]1.[ClH:44].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][cH:8][c:9]2[c:10]1[NH:11][C:12]1=[C:17]([C:16](=[O:38])[CH2:15][NH:14][CH2:13]1)[CH:18]2[c:19]1[o:20][c:21]([S:24][c:25]2[n:26][c:27]3[c:28]([nH:29]2)[cH:30][cH:31][c:32]([O:34][CH:35]([F:36])[F:37])[cH:33]3)[cH:22][cH:23]1.[ClH:44]

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 178470376HCID 178470376, compound

Product 2

HCID 313Hydrochloric AcidHCID 178470366HCID 178470366, compound

Sources & evidence

ORD record
ord-9c531faf1dfd436688cef05ed38d2f3f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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