Acetic Acid → HCID 58531635, compound

HRID 182759Notes

Reaction equation

HRID 182759 reaction equation
[CH3:38][C:39](=[O:40])[OH:41].[Cl:1][c:2]1[c:3]([OH:37])[c:4]([S:9](=[O:10])(=[O:11])[N:12]([CH2:13][c:14]2[cH:15][c:16](-[c:20]3[cH:21][cH:22][c:23]([N+:26]([O-:27])=[O:28])[cH:24][cH:25]3)[cH:17][cH:18][cH:19]2)[CH2:29][c:30]2[cH:31][cH:32][c:33]([F:36])[cH:34][cH:35]2)[cH:5][c:6]([Cl:8])[cH:7]1.[Fe:42]>>[Cl:1][c:2]1[c:3]([OH:37])[c:4]([S:9](=[O:10])(=[O:11])[N:12]([CH2:13][c:14]2[cH:15][c:16](-[c:20]3[cH:21][cH:22][c:23]([NH2:26])[cH:24][cH:25]3)[cH:17][cH:18][cH:19]2)[CH2:29][c:30]2[cH:31][cH:32][c:33]([F:36])[cH:34][cH:35]2)[cH:5][c:6]([Cl:8])[cH:7]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 23925IronHCID 58531544HCID 58531544, compound

Product 1

HCID 58531635HCID 58531635, compound

Sources & evidence

ORD record
ord-5f5e6fbf249b4071a4d512ee3b8c2724
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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