Hydrochloric Acid → HCID 67405047, compound

HRID 1117014Notes

Reaction equation

HRID 1117014 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][c:8]1[n:9][cH:10][n:11][c:12]([S:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][cH:20][c:21]([C:25]([NH:26][c:27]4[cH:28][c:29]([C:34]([F:35])([F:36])[F:37])[c:30]([F:33])[cH:31][cH:32]4)=[O:38])[c:22]3[cH:23][cH:24]2)[cH:13]1)([CH3:5])([CH3:6])[CH3:39].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[ClH:40].[Na+:57].[O-:53][C:54]([OH:55])=[O:56].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH2:58]>>[NH2:7][c:8]1[n:9][cH:10][n:11][c:12]([S:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][cH:20][c:21]([C:25]([NH:26][c:27]4[cH:28][c:29]([C:34]([F:35])([F:36])[F:37])[c:30]([F:33])[cH:31][cH:32]4)=[O:38])[c:22]3[cH:23][cH:24]2)[cH:13]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 67406687HCID 67406687, compound

Product 1

HCID 67405047HCID 67405047, compound

Sources & evidence

ORD record
ord-7362920eeeca471ab4690b124149ddbc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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