Potassium Cation → (+/-)-(5-Fluoro-7-phenyl-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate

HRID 213496Notes

Reaction equation

HRID 213496 reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:11][CH2:12][CH:13]2[O:14][c:15]3[c:16]([cH:18][c:19]([F:23])[cH:20][c:21]3[Br:22])[CH2:17]2)[cH:6][cH:7]1.[K+:37].[K+:38].[c:24]1([B:30]([OH:31])[OH:32])[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:11][CH2:12][CH:13]2[O:14][c:15]3[c:16]([cH:18][c:19]([F:23])[cH:20][c:21]3-[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:17]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 86599113(+/-)-(7-Bromo-5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate

Product 1

HCID 86599114(+/-)-(5-Fluoro-7-phenyl-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate

Sources & evidence

ORD record
ord-4b2cd73c663142d8a143db973d3c7017
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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