Acetic Acid → HCID 15858476, compound

HRID 316792Notes

Reaction equation

HRID 316792 reaction equation
[C:25]([OH:26])(=[O:27])[CH3:28].[CH3:1][c:2]1[c:3]([C:11]([CH3:12])([OH:13])[c:14]2[cH:15][c:16]([CH:22]([CH3:23])[CH3:24])[c:17]([O:20][CH3:21])[cH:18][cH:19]2)[c:4]([CH3:10])[cH:5][c:6]([O:8][CH3:9])[cH:7]1.[CH3:31][CH2:32][OH:33].[H:29][H:30]>>[CH3:1][c:2]1[c:3]([CH:11]([CH3:12])[c:14]2[cH:15][c:16]([CH:22]([CH3:23])[CH3:24])[c:17]([O:20][CH3:21])[cH:18][cH:19]2)[c:4]([CH3:10])[cH:5][c:6]([O:8][CH3:9])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 54537602HCID 54537602, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 15858476HCID 15858476, compound

Sources & evidence

ORD record
ord-a1dcdb1d41c4453eba55f7e42ee9e65f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…