Acetic Acid → HCID 18791026, compound

HRID 112356Notes

Reaction equation

HRID 112356 reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[CH3:5][CH2:6][OH:7].[Cl:8][c:9]1[c:10](-[c:19]2[n:20][n:21]([CH3:32])[c:22]([C:28]([F:29])([F:30])[F:31])[c:23]2[C:24]([F:25])([F:26])[F:27])[cH:11][c:12]([N+:16]([O-:17])=[O:18])[c:13]([Cl:15])[cH:14]1.[Fe:33]>>[Cl:8][c:9]1[c:10](-[c:19]2[n:20][n:21]([CH3:32])[c:22]([C:28]([F:29])([F:30])[F:31])[c:23]2[C:24]([F:25])([F:26])[F:27])[cH:11][c:12]([NH2:16])[c:13]([Cl:15])[cH:14]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 8857Ethyl AcetateHCID 23925IronHCID 18791015HCID 18791015, compound

Product 1

HCID 18791026HCID 18791026, compound

Sources & evidence

ORD record
ord-6025ba5c5a3d4cafb71062f77914785c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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