Acetic Acid → 5-Bromo-2-(2,2-dimethylpropionylamino)-3-hydroxy-6-nitrobenzoic acid

반응식

[Br:1][c:2]1[cH:3][c:4]([OH:18])[c:5]([NH:11][C:12]([C:13]([CH3:14])([CH3:15])[CH3:16])=[O:17])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1.[CH3:23][C:24](=[O:25])[OH:26].[OH:19][N+:20]([O-:21])=[O:22]>>[Br:1][c:2]1[cH:3][c:4]([OH:18])[c:5]([NH:11][C:12]([C:13]([CH3:14])([CH3:15])[CH3:16])=[O:17])[c:6]([C:7](=[O:8])[OH:9])[c:10]1[N+:20](=[O:19])[O-:21]

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 944Nitric Acid

HCID 685848145-Bromo-2-(2,2-dimethylpropionylamino)-3-hydroxybenzoic Acid

생성물 1

HCID 866308645-Bromo-2-(2,2-dimethylpropionylamino)-3-hydroxy-6-nitrobenzoic acid

출처 및 근거

ORD 기록: ord-f5517138787542aeaed1f71772e05ebe
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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