Acetic Acid → HCID 19912217, compound

HRID 684693Notes

Reaction equation

HRID 684693 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[Cl:1][c:2]1[c:3](-[n:20]2[n:21][c:22]([CH3:29])[n:23]([CH:26]([F:27])[F:28])[c:24]2=[O:25])[cH:4][c:5]([O:9][c:10]2[c:11]([Cl:19])[cH:12][c:13]([N+:16]([O-:17])=[O:18])[cH:14][cH:15]2)[c:6]([Cl:8])[cH:7]1.[Fe:35].[OH2:34]>>[Cl:1][c:2]1[c:3](-[n:20]2[n:21][c:22]([CH3:29])[n:23]([CH:26]([F:27])[F:28])[c:24]2=[O:25])[cH:4][c:5]([O:9][c:10]2[c:11]([Cl:19])[cH:12][c:13]([NH2:16])[cH:14][cH:15]2)[c:6]([Cl:8])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 23925IronHCID 19912233HCID 19912233, compound

Product 1

HCID 19912217HCID 19912217, compound

Sources & evidence

ORD record
ord-097fe32c4dc94db39e5e45209018666d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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