Acetic Acid → HCID 3021979, compound

HRID 2143144Notes

Reaction equation

HRID 2143144 reaction equation
[CH3:29][C:30](=[O:31])[OH:32].[CH3:33][CH2:34][OH:35].[F:3][c:4]1[cH:5][cH:6][c:7](-[n:10]2[cH:11][c:12]([C:13](=[O:14])[O:15][CH3:16])[c:17](=[O:28])[cH:18][c:19]2[CH:20]=[CH:21][c:22]2[cH:23][n:24][cH:25][cH:26][cH:27]2)[cH:8][cH:9]1.[Na+:2].[OH-:1]>>[F:3][c:4]1[cH:5][cH:6][c:7](-[n:10]2[cH:11][c:12]([C:13](=[O:14])[OH:15])[c:17](=[O:28])[cH:18][c:19]2[CH:20]=[CH:21][c:22]2[cH:23][n:24][cH:25][cH:26][cH:27]2)[cH:8][cH:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 54473243HCID 54473243, compound

Product 1

HCID 3021979HCID 3021979, compound

Sources & evidence

ORD record
ord-b3635a2c4ebe4857b42d00888f123afd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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