Hydrochloric Acid → 4-(4-Amino-2,6-dibromophenoxy)-2-isopropylphenol

HRID 1570656Notes

Reaction equation

[Br:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH:12]([CH3:13])[CH3:14])[c:8]([OH:11])[cH:9][cH:10]2)[c:15]([Br:22])[cH:16][c:17]([N+:19]([O-:20])=[O:21])[cH:18]1.[C:32](=[O:33])([OH:34])[O-:35].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[ClH:31].[Na+:29].[Na+:30].[Na+:36].[OH2:42].[S:23]([S:24]([O-:25])=[O:26])([O-:27])=[O:28]>>[Br:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH:12]([CH3:13])[CH3:14])[c:8]([OH:11])[cH:9][cH:10]2)[c:15]([Br:22])[cH:16][c:17]([NH2:19])[cH:18]1

Participants

Reactant 8

HCID 313Hydrochloric Acid

HCID 769Bicarbonate Ion

HCID 923Sodium ion3×

HCID 962Water

HCID 1086Dithionite

HCID 8028Tetrahydrofuran

HCID 8857Ethyl Acetate

HCID 226603024-(2,6-Dibromo-4-nitrophenoxy)-2-isopropylphenol

Product 1

HCID 121504324-(4-Amino-2,6-dibromophenoxy)-2-isopropylphenol

Sources & evidence

ORD record: ord-98a0ec7481b642a2a887dd06950ff9f8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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