Acetic Acid → HCID 59355663, compound

HRID 682556Notes

Reaction equation

HRID 682556 reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:34][CH2:35][OH:36].[Cl:6][c:7]1[cH:8][c:9]([C:14]2([C:29]([F:30])([F:31])[F:32])[CH2:15][C:16]([c:19]3[cH:20][cH:21][c:22]([Cl:28])[c:23]([N+:25]([O-:26])=[O:27])[cH:24]3)=[N:17][O:18]2)[cH:10][c:11]([Cl:13])[cH:12]1.[Fe:33].[OH2:5]>>[Cl:6][c:7]1[cH:8][c:9]([C:14]2([C:29]([F:30])([F:31])[F:32])[CH2:15][C:16]([c:19]3[cH:20][cH:21][c:22]([Cl:28])[c:23]([NH2:25])[cH:24]3)=[N:17][O:18]2)[cH:10][c:11]([Cl:13])[cH:12]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 962WaterHCID 23925IronHCID 59355668HCID 59355668, compound

Product 1

HCID 59355663HCID 59355663, compound

Sources & evidence

ORD record
ord-979043c8e40445c4b0a173feaabee7bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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