Water → HCID 66691509, compound

HRID 210069Notes

Reaction equation

HRID 210069 reaction equation
[C:23](=[O:24])([O-:25])[O-:26].[CH3:40][C:41]#[N:42].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cs+:27].[Cs+:28].[F:29][c:30]1[c:31]([F:39])[cH:32][c:33]([N+:36](=[O:37])[O-:38])[cH:34][cH:35]1.[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:54].[OH:1][c:2]1[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][C:16]3([C:19](=[O:20])[O:21][CH3:22])[CH2:17][CH2:18]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12>>[O:1]([c:2]1[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][C:16]3([C:19](=[O:20])[O:21][CH3:22])[CH2:17][CH2:18]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12)[c:30]1[c:31]([F:39])[cH:32][c:33]([N+:36](=[O:37])[O-:38])[cH:34][cH:35]1

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 1230531,2-Difluoro-4-nitrobenzeneHCID 178498907HCID 178498907, compound

Product 1

HCID 66691509HCID 66691509, compound

Sources & evidence

ORD record
ord-80cd45ef75004f70bbeff246375ffa5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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