Potassium Cation → HCID 136333676, compound

HRID 1213258Notes

Reaction equation

HRID 1213258 reaction equation
[C:14](=[O:15])([O-:16])[O-:17].[CH3:1][O:2][C:3](=[O:4])[CH2:5][c:6]1[cH:7][cH:8][c:9]([OH:10])[c:11]([Cl:12])[cH:13]1.[CH3:44][CH:45]([c:46]1[cH:47][cH:48][c:49]([O:50][CH2:51][CH2:52][CH:53]([O:54][c:55]2[cH:56][cH:57][c:58]3[c:59](-[c:60]4[cH:61][cH:62][cH:63][cH:64][cH:65]4)[n:66][o:67][c:68]3[c:69]2[CH2:70][CH:71]2[CH2:72][CH2:73]2)[CH3:74])[c:75]([Cl:76])[cH:77]1)[C:78]([OH:79])=[O:80].[CH3:88][OH:89].[CH:20]1([CH2:23][c:24]2[c:25]([O:39][CH2:40][CH2:41][CH2:42][Br:43])[cH:26][cH:27][c:28]3[c:29](-[c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[n:30][o:31][c:32]23)[CH2:21][CH2:22]1.[K+:18].[K+:19].[Li+:81].[O:83]=[CH:84][N:85]([CH3:86])[CH3:87].[OH-:82].[OH2:90]>>[CH:20]1([CH2:23][c:24]2[c:25]([OH:39])[cH:26][cH:27][c:28]3[c:29](-[c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[n:30][o:31][c:32]23)[CH2:21][CH2:22]1

Participants

11

Reactant 10

HCID 813Potassium Cation2×HCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 28486Lithium ionHCID 92625Methyl 3-chloro-4-hydroxyphenylacetateHCID 69967358HCID 69967358, compoundHCID 69968717HCID 69968717, compound

Product 1

HCID 136333676HCID 136333676, compound

Sources & evidence

ORD record
ord-a386bb69424846e5abe25ba4fe8d95e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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