Water → HCID 10128697, compound

HRID 2152168Notes

Reaction equation

HRID 2152168 reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[Cl:1][c:2]1[c:3](-[c:9]2[c:10](-[c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[cH:11][c:12]([C:16](=[O:17])[O:18][CH3:19])[c:13](=[O:15])[nH:14]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cs+:41].[Cs+:42].[F:27][c:28]1[cH:29][c:30]([CH2:31][Br:32])[cH:33][cH:34][c:35]1[F:36].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:48]>>[Cl:1][c:2]1[c:3](-[c:9]2[c:10](-[c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[cH:11][c:12]([C:16](=[O:17])[O:18][CH3:19])[c:13]([O:15][CH2:31][c:30]3[cH:29][c:28]([F:27])[c:35]([F:36])[cH:34][cH:33]3)[n:14]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 5814364-(Bromomethyl)-1,2-difluorobenzeneHCID 69416016HCID 69416016, compound

Product 1

HCID 10128697HCID 10128697, compound

Sources & evidence

ORD record
ord-9264167458fb4668a457c3389d7bb34c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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