Acetic Acid → HCID 21402603, compound

HRID 300400Notes

Reaction equation

HRID 300400 reaction equation
[BrH:21].[C:22]([O-:23])(=[O:24])[OH:25].[C:27](=[O:28])([OH:29])[O-:30].[CH2:1]([CH2:2][CH3:3])[c:4]1[cH:5][c:6]([CH2:18][CH2:19][CH3:20])[c:7]2[c:8]([c:9](=[O:16])[cH:10][c:11]([C:13](=[O:14])[NH2:15])[o:12]2)[cH:17]1.[CH3:31][C:32](=[O:33])[OH:34].[Na+:26]>>[CH2:1]([CH2:2][CH3:3])[c:4]1[cH:5][c:6]([CH2:18][CH2:19][CH3:20])[c:7]2[c:8]([c:9](=[O:16])[cH:10][c:11]([C:13](=[O:14])[OH:23])[o:12]2)[cH:17]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 769Bicarbonate Ion2×HCID 923Sodium ionHCID 21402618HCID 21402618, compound

Product 1

HCID 21402603HCID 21402603, compound

Sources & evidence

ORD record
ord-d2cdf065e8db4ae5a46bd0f3298b19e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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