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Sodium Ion → ethyl 3-[4-({4-[(3,5-di-tert-butyl-1H-pyrazol-1-yl)methyl]benzyl}oxy)-2-fluorophenyl]propanoate

HRID 211294
Notes
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Reaction equation

HRID 211294 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][nH:7][c:8]([C:10]([CH3:11])([CH3:12])[CH3:13])[cH:9]1.[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[Cl:16][CH2:17][c:18]1[cH:19][cH:20][c:21]([CH2:22][O:23][c:24]2[cH:25][c:26]([F:37])[c:27]([CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:28][cH:29]2)[cH:38][cH:39]1.[H-:14].[Na+:15].[OH2:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:17][c:18]2[cH:19][cH:20][c:21]([CH2:22][O:23][c:24]3[cH:25][c:26]([F:37])[c:27]([CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:28][cH:29]3)[cH:38][cH:39]2)[c:8]([C:10]([CH3:11])([CH3:12])[CH3:13])[cH:9]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 1369123,5-Di-t-butylpyrazoleHCID 166653HydrideHCID 23143241Ethyl 3-(4-([4-(chloromethyl)benzyl]oxy}-2-fluorophenyl)propanoate

Product 1

HCID 23159844
ethyl 3-[4-({4-[(3,5-di-tert-butyl-1H-pyrazol-1-yl)methyl]benzyl}oxy)-2-fluorophenyl]propanoate

Sources & evidence

ORD record
ord-b985c1b7255d43719bec299b50b4bd04
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes