Acetic Acid → HCID 62679045, compound

HRID 685438Notes

Reaction equation

HRID 685438 reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH3:23][CH2:24][OH:25].[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([F:18])[cH:6][c:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][cH:13][cH:14][n:15]2)[cH:16][cH:17]1>>[NH2:1][c:4]1[c:5]([F:18])[cH:6][c:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][cH:13][cH:14][n:15]2)[cH:16][cH:17]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 8857Ethyl AcetateHCID 62681258HCID 62681258, compound

Product 1

HCID 62679045HCID 62679045, compound

Sources & evidence

ORD record
ord-28e58d71860048cab0f26bb7e83321d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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