Water → HCID 67330843, compound

HRID 1137367Notes

Reaction equation

HRID 1137367 reaction equation
[C:34](=[O:35])([O-:36])[O-:37].[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]([CH3:31])[Br:32])[cH:26][cH:27]2)=[O:33])[C:10](=[O:13])[O:11][CH2:12]1.[Cs+:38].[Cs+:39].[F:40][C:41]([c:42]1[cH:43][cH:44][c:45]([OH:48])[cH:46][cH:47]1)([F:49])[F:50].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:56]>>[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]([CH3:31])[O:48][c:45]3[cH:44][cH:43][c:42]([C:41]([F:40])([F:49])[F:50])[cH:47][cH:46]3)[cH:26][cH:27]2)=[O:33])[C:10](=[O:13])[O:11][CH2:12]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 678744-(Trifluoromethyl)phenolHCID 104967Cesium cation2×HCID 67331046HCID 67331046, compound

Product 1

HCID 67330843HCID 67330843, compound

Sources & evidence

ORD record
ord-a0ff7711ff4d4ea1a5cdedea7d9c4820
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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