Sodium ion → Methyl 7-(4-hydroxyphenyl)-3-isoquinolinecarboxylate

HRID 122344Notes

Reaction equation

HRID 122344 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH3:23][C:24]1([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29][B:30]([c:31]2[cH:32][cH:33][c:34]([OH:37])[cH:35][cH:36]2)[O:38]1.[CH3:45][O:46][CH2:47][CH2:48][O:49][CH3:50].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][cH:9][c:10]2[cH:11][c:12]([C:17](=[O:18])[O:19][CH3:20])[n:13][cH:14][c:15]2[cH:16]1)(=[O:21])=[O:22].[Na+:43].[Na+:44]>>[c:7]1(-[c:31]2[cH:32][cH:33][c:34]([OH:37])[cH:35][cH:36]2)[cH:8][cH:9][c:10]2[cH:11][c:12]([C:17](=[O:18])[O:19][CH3:20])[n:13][cH:14][c:15]2[cH:16]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27346244-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenolHCID 59321500Methyl 7-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate

Product 1

HCID 59321463Methyl 7-(4-hydroxyphenyl)-3-isoquinolinecarboxylate

Sources & evidence

ORD record
ord-225b8084a8904fe08dcd1282abed32f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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