Potassium Cation → HCID 178453305, compound

HRID 1202566Notes

Reaction equation

HRID 1202566 reaction equation
[C:1]([O:2][CH3:3])([O:4][CH3:5])([O:6][CH3:7])[CH3:8].[C:62]([Br:63])(=[O:64])[CH3:65].[CH2:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[O:16][c:17]1[c:18]([F:37])[cH:19][c:20]([CH2:21][CH:22]([CH:23]([CH2:24][OH:25])[OH:26])[NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[cH:35][cH:36]1.[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH3:71][OH:72].[Cl:68][CH2:69][Cl:70].[K+:67].[OH-:66].[c:38]1([CH3:39])[cH:40][cH:41][c:42]([S:43]([O-:44])(=[O:45])=[O:46])[cH:47][cH:48]1.[nH+:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[CH2:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[O:16][c:17]1[c:18]([F:37])[cH:19][c:20]([CH2:21][CH:22]([CH:23]2[CH2:24][O:25]2)[NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[cH:35][cH:36]1

Participants

11

Reactant 10

HCID 813Potassium CationHCID 887MethanolHCID 961HydroxideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 10482Acetyl bromideHCID 15050Trimethyl orthoacetateHCID 85570p-ToluenesulfonateHCID 4989215PyridiniumHCID 178453306HCID 178453306, compound

Product 1

HCID 178453305HCID 178453305, compound

Sources & evidence

ORD record
ord-b7215dd0f4034cf68076d4224259f1d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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