Acetic Acid → HCID 9899188, compound

HRID 1121234Notes

Reaction equation

HRID 1121234 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH2:6][O:7][c:8]1[cH:9][c:10]2[c:11]([cH:16][cH:17]1)[O:12][CH2:13][C:14]2=[O:15].[CH3:31][CH2:32][OH:33].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:44][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49].[Cl-:24].[Na+:25].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1.[OH2:18].[S:19](=[O:20])(=[O:21])([OH:22])[OH:23]>>[O:3]=[C:4]([OH:5])[CH2:6][O:7][c:8]1[cH:9][c:10]2[c:11]([cH:16][cH:17]1)[O:12][CH2:13][C:14]2=[O:15]

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 312ChlorideHCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 1118Sulfuric AcidHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 17937805HCID 17937805, compound

Product 1

HCID 9899188HCID 9899188, compound

Sources & evidence

ORD record
ord-444b47196373463198d9d2dbd818b43e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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