Sodium ion → Ethyl 3-oxo-3-(4-phenyloxyphenyl)-2-((3-((1,1,2,2-tetrafluoroethyl)oxy)phenyl)methyl)propionate

HRID 295156Notes

Reaction equation

HRID 295156 reaction equation
[Br:15][N:16]1[C:17](=[O:18])[CH2:19][CH2:20][C:21]1=[O:22].[C:73]([Cl:74])([Cl:75])([Cl:76])[Cl:77].[CH3:78][O:79][CH2:80][CH2:81][O:82][CH3:83].[F:1][C:2]([CH:3]([F:4])[F:5])([O:6][c:7]1[cH:8][c:9]([CH3:13])[cH:10][cH:11][cH:12]1)[F:14].[F:58][C:59]([F:60])([O:61][c:62]1[cH:63][c:64]([CH2:65][Br:66])[cH:67][cH:68][cH:69]1)[CH:70]([F:71])[F:72].[H-:56].[N:23]([C:24]([CH3:25])([CH3:26])[C:27]#[N:28])=[N:29][C:30]([CH3:31])([CH3:32])[C:33]#[N:34].[Na+:57].[O:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[c:42]1[cH:43][cH:44][c:45]([C:48]([CH2:49][C:50](=[O:51])[O:52][CH2:53][CH3:54])=[O:55])[cH:46][cH:47]1.[OH2:84]>>[F:1][C:2]([CH:3]([F:4])[F:5])([O:6][c:7]1[cH:8][c:9]([CH2:13][CH:49]([C:48]([c:45]2[cH:44][cH:43][c:42]([O:35][c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:47][cH:46]2)=[O:55])[C:50](=[O:51])[O:52][CH2:53][CH3:54])[cH:10][cH:11][cH:12]1)[F:14]

Participants

11

Reactant 10

HCID 923Sodium ionHCID 962WaterHCID 5943Carbon TetrachlorideHCID 6547AzobisisobutyronitrileHCID 80711,2-DimethoxyethaneHCID 67184N-bromobutanimideHCID 74438Benzene, 1-methyl-3-(1,1,2,2-tetrafluoroethoxy)-HCID 166653HydrideHCID 2760258Ethyl 3-oxo-3-(4-phenoxyphenyl)propanoateHCID 114603781-(Bromomethyl)-3-(1,1,2,2-tetrafluoroethoxy)benzene

Product 1

HCID 22261740Ethyl 3-oxo-3-(4-phenyloxyphenyl)-2-((3-((1,1,2,2-tetrafluoroethyl)oxy)phenyl)methyl)propionate

Sources & evidence

ORD record
ord-82aa108f542248e6adaf8fb6d7098822
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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