Acetic Acid → HCID 14726499, compound

HRID 301462Notes

Reaction equation

HRID 301462 reaction equation
[C:1](=[O:2])([O:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]([C:12](=[O:13])[c:14]2[cH:15][c:16]3[c:21]([cH:22][cH:23]2)[C:20]([CH3:24])([CH3:25])[CH2:19][CH2:18][C:17]3([CH3:26])[CH3:27])=[O:28])[cH:9][cH:10]1.[CH3:29][C:30](=[O:31])[OH:32].[OH2:33].[S:34](=[O:35])(=[O:36])([OH:37])[OH:38]>>[C:1](=[O:2])([OH:3])[c:5]1[cH:6][cH:7][c:8]([C:11]([C:12](=[O:13])[c:14]2[cH:15][c:16]3[c:21]([cH:22][cH:23]2)[C:20]([CH3:24])([CH3:25])[CH2:19][CH2:18][C:17]3([CH3:26])[CH3:27])=[O:28])[cH:9][cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 1118Sulfuric AcidHCID 14726493HCID 14726493, compound

Product 1

HCID 14726499HCID 14726499, compound

Sources & evidence

ORD record
ord-ee5440f9f04d4b348479c8ff396b3e05
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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