Acetic Acid → HCID 67343871, compound

HRID 194662Notes

Reaction equation

HRID 194662 reaction equation
[CH3:1][OH:2].[CH3:29][C:30](=[O:31])[OH:32].[Fe:28].[o:3]1[c:4](-[c:12]2[cH:13][c:14]([N+:25]([O-:26])=[O:27])[c:15]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:23][cH:24]2)[cH:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2>>[o:3]1[c:4](-[c:12]2[cH:13][c:14]([NH2:25])[c:15]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:23][cH:24]2)[cH:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 23925IronHCID 67342892HCID 67342892, compound

Product 1

HCID 67343871HCID 67343871, compound

Sources & evidence

ORD record
ord-bef4c5cc1e5445fa899c22cfbca8ebb2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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