Acetic Acid → Tert-butyl 2-amino-4-bromobenzoate

HRID 118996Notes

Reaction equation

HRID 118996 reaction equation
[Br:7][c:8]1[cH:9][c:10]([N+:21]([O-:22])=[O:23])[c:11]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[cH:19][cH:20]1.[C:24](=[O:25])([O-:26])[OH:27].[CH3:1][OH:2].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:3][C:4](=[O:5])[OH:6].[Fe:29].[Na+:28]>>[Br:7][c:8]1[cH:9][c:10]([NH2:21])[c:11]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[cH:19][cH:20]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 23925IronHCID 26369829tert-Butyl 4-bromo-2-nitrobenzoate

Product 1

HCID 58508534Tert-butyl 2-amino-4-bromobenzoate

Sources & evidence

ORD record
ord-b4db4659ca074f6ebd98a80cc8a76c27
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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