Acetic Acid → Hydrochloric Acid

HRID 664640Notes

Reaction equation

HRID 664640 reaction equation
[C:1]([O:2][C:3]([CH3:4])([CH3:5])[CH3:6])(=[O:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1)[C:18](=[O:19])[NH:20][CH:21]([CH2:22][CH2:23][S:24][CH3:25])[C:26](=[O:27])[NH:28][CH2:29][C:30](=[O:31])[NH:32][CH:33]([CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[C:41](=[O:42])[CH:43]1[C:44]2([C:54](=[O:55])[NH2:56])[CH2:45][CH:46]3[CH2:47][CH:48]([CH2:49][C:50]1([NH2:52])[CH2:51]3)[CH2:53]2.[CH3:58][C:59](=[O:60])[OH:61].[ClH:57].[O:62]1[CH2:63][CH2:64][O:65][CH2:66][CH2:67]1>>[ClH:57].[NH2:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1)[C:18](=[O:19])[NH:20][CH:21]([CH2:22][CH2:23][S:24][CH3:25])[C:26](=[O:27])[NH:28][CH2:29][C:30](=[O:31])[NH:32][CH:33]([CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[C:41](=[O:42])[CH:43]1[C:44]2([C:54](=[O:55])[NH2:56])[CH2:45][CH:46]3[CH2:47][CH:48]([CH2:49][C:50]1([NH2:52])[CH2:51]3)[CH2:53]2

Participants

6

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 178503754HCID 178503754, compound

Product 2

HCID 313Hydrochloric AcidHCID 178503766HCID 178503766, compound

Sources & evidence

ORD record
ord-9e5946cbe2eb4f278fbb88293f8fa46e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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