Hydrochloric Acid → 2-Bromo-5-chloro-N-methoxy-N-methylbenzamide

HRID 1548059Notes

Reaction equation

HRID 1548059 reaction equation
[Br:10][c:11]1[c:12]([C:13](=[O:14])[OH:15])[cH:16][c:17]([Cl:20])[cH:18][cH:19]1.[CH3:21][NH:22][O:23][CH3:24].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:25].[OH2:55].[P-:26]([F:27])([F:28])([F:29])([F:30])([F:31])[F:32].[n:33]1([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[N+:39]([CH3:40])[CH3:41])[c:42]2[n:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[Br:10][c:11]1[c:12]([C:13](=[O:14])[N:22]([CH3:21])[O:23][CH3:24])[cH:16][c:17]([Cl:20])[cH:18][cH:19]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 14232N,O-DimethylhydroxylamineHCID 81531DiisopropylethylamineHCID 890272-Bromo-5-chlorobenzoic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 222365462-Bromo-5-chloro-N-methoxy-N-methylbenzamide

Sources & evidence

ORD record
ord-2abe65d85eea4e4eb6977d3d831add18
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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