Water → HCID 76624811, compound

HRID 1240618Notes

Reaction equation

HRID 1240618 reaction equation
[Br:7][CH2:8][CH:9]([F:10])[F:11].[C:1](=[O:2])([O-:3])[O-:4].[CH3:12][c:13]1[n:14][cH:15][n:16](-[c:18]2[c:19]([OH:45])[n:20][c:21]([CH:24]=[CH:25][c:26]3[n:27][n:28]4[c:29]([n:44]3)[CH:30]([c:34]3[c:35]([C:40]([F:41])([F:42])[F:43])[cH:36][cH:37][cH:38][cH:39]3)[CH2:31][CH2:32][CH2:33]4)[cH:22][cH:23]2)[cH:17]1.[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cs+:5].[Cs+:6].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH2:57]>>[CH2:8]([CH:9]([F:10])[F:11])[O:45][c:19]1[c:18](-[n:16]2[cH:15][n:14][c:13]([CH3:12])[cH:17]2)[cH:23][cH:22][c:21]([CH:24]=[CH:25][c:26]2[n:27][n:28]3[c:29]([n:44]2)[CH:30]([c:34]2[c:35]([C:40]([F:41])([F:42])[F:43])[cH:36][cH:37][cH:38][cH:39]2)[CH2:31][CH2:32][CH2:33]3)[n:20]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 1361862-Bromo-1,1-difluoroethaneHCID 178429902HCID 178429902, compound

Product 1

HCID 76624811HCID 76624811, compound

Sources & evidence

ORD record
ord-87a661a5031b476f8f10a832ab4b2021
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…