Acetic Acid → HCID 67069927, compound

HRID 1229412Notes

Reaction equation

HRID 1229412 reaction equation
[BrH:33].[C:39]([OH:40])(=[O:41])[CH3:42].[NH2:1][c:2]1[c:3]([CH2:20][CH2:21][c:22]2[cH:23][cH:24][c:25]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:26][cH:27]2)[cH:4][c:5]([C:16]([CH3:17])([CH3:18])[CH3:19])[cH:6][c:7]1-[c:8]1[c:9]([O:14][CH3:15])[n:10][cH:11][cH:12][cH:13]1.[Na+:38].[O-:34][C:35]([OH:36])=[O:37]>>[NH2:1][c:2]1[c:3]([CH2:20][CH2:21][c:22]2[cH:23][cH:24][c:25]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:26][cH:27]2)[cH:4][c:5]([C:16]([CH3:17])([CH3:18])[CH3:19])[cH:6][c:7]1-[c:8]1[c:9](=[O:14])[nH:10][cH:11][cH:12][cH:13]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 769Bicarbonate IonHCID 923Sodium ionHCID 67070018HCID 67070018, compound

Product 1

HCID 67069927HCID 67069927, compound

Sources & evidence

ORD record
ord-dff0134fa7ab45028b8ee8fa345d774f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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