Hydrochloric Acid → 2-Bromo-4-[[[(3-hydroxyphenyl)methyl]amino]carbonyl]benzoic acid

HRID 152851

Reaction equation

HRID 152851 reaction equation
[Br:10][c:11]1[c:12]([C:20](=[O:21])[OH:22])[cH:13][cH:14][c:15]([C:17](=[O:18])[OH:19])[cH:16]1.[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[ClH:47].[OH:48][c:49]1[cH:50][c:51]([CH2:55][NH2:56])[cH:52][cH:53][cH:54]1.[OH:57][n:58]1[c:59]2[c:60]([cH:61][cH:62][cH:63][cH:64]2)[n:65][n:66]1.[P-:23]([F:24])([F:25])([F:26])([F:27])([F:28])[F:29].[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[Br:10][c:11]1[c:12]([C:20](=[O:21])[OH:22])[cH:13][cH:14][c:15]([C:17](=[O:19])[NH:56][CH2:55][c:51]2[cH:50][c:49]([OH:48])[cH:54][cH:53][cH:52]2)[cH:16]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 68513Bromoterephthalic acidHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 7358943-(Aminomethyl)phenol

Product 1

HCID 226613232-Bromo-4-[[[(3-hydroxyphenyl)methyl]amino]carbonyl]benzoic acid

Sources & evidence

ORD record
ord-e301b3da9a4c4e17ad4bad900ac9e2d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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