Water → HCID 67329827, compound

HRID 2332703Notes

Reaction equation

HRID 2332703 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH2:15][CH:16]([c:17]2[n:18][o:19][cH:20][cH:21]2)[c:22]2[cH:23][cH:24][c:25]([O:28][CH2:29][CH:30]([CH2:31][CH3:32])[Br:33])[cH:26][cH:27]2)=[O:34])[C:10](=[O:13])[O:11][CH2:12]1.[Cs+:39].[Cs+:40].[F:41][C:42]([c:43]1[cH:44][cH:45][c:46]([OH:49])[cH:47][cH:48]1)([F:50])[F:51].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:57]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH2:15][CH:16]([c:17]2[n:18][o:19][cH:20][cH:21]2)[c:22]2[cH:23][cH:24][c:25]([O:28][CH2:29][CH:30]([CH2:31][CH3:32])[O:49][c:46]3[cH:45][cH:44][c:43]([C:42]([F:41])([F:50])[F:51])[cH:48][cH:47]3)[cH:26][cH:27]2)=[O:34])[C:10](=[O:13])[O:11][CH2:12]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 678744-(Trifluoromethyl)phenolHCID 104967Cesium cation2×HCID 67330923HCID 67330923, compound

Product 1

HCID 67329827HCID 67329827, compound

Sources & evidence

ORD record
ord-f7a4b88652d044df8246d78e3be90f4a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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