Ammonium → HCID 57618438, compound

HRID 2122508Notes

Reaction equation

HRID 2122508 reaction equation
[B:5]([OH:6])([OH:7])[c:8]1[cH:9][c:10]([F:17])[c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]1.[CH3:1][NH:2][CH2:3][CH3:4].[Cl-:42].[ClH:44].[NH4+:43].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH2:45].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[n:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[CH3:1][N:2]([CH2:3][CH3:4])[C:12]([c:11]1[c:10]([F:17])[cH:9][c:8]([B:5]([OH:6])[OH:7])[cH:16][cH:15]1)=[O:14]

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312ChlorideHCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 12219N-MethylethylamineHCID 27632014-Carboxy-3-fluorophenylboronic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 57618438HCID 57618438, compound

Sources & evidence

ORD record
ord-8e6facceb11541b7bec1909f3ae2d1f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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