Acetic Acid → HCID 178491353, compound

HRID 210509Notes

Reaction equation

HRID 210509 reaction equation
[BrH:1].[CH2:2]([O:3][C:4](=[O:5])[N:12]1[CH2:13][c:14]2[c:15]([n:18][c:19]([NH:21][C:22](=[NH:23])[NH:24][CH2:25][c:26]3[c:27]([O:34][CH3:35])[cH:28][cH:29][cH:30][c:31]3[O:32][CH3:33])[s:20]2)[CH2:16][CH2:17]1)[c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1.[CH3:40][C:41](=[O:42])[OH:43].[CH3:44][OH:45].[O-:36][C:37](=[O:38])[O-:39]>>[NH:12]1[CH2:13][c:14]2[c:15]([n:18][c:19]([NH:21][C:22](=[NH:23])[NH:24][CH2:25][c:26]3[c:27]([O:34][CH3:35])[cH:28][cH:29][cH:30][c:31]3[O:32][CH3:33])[s:20]2)[CH2:16][CH2:17]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 887MethanolHCID 19660Carbonate IonHCID 178491355HCID 178491355, compound

Product 1

HCID 178491353HCID 178491353, compound

Sources & evidence

ORD record
ord-b43fbe7be1b346e3a6595c2153b06cfe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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