Sodium ion → [4-(4-chlorophenyl)sulfanyl-5,8-difluoro-3,4-dihydro-2H-chromen-3-yl]methanol

HRID 292876Notes

Reaction equation

HRID 292876 reaction equation
[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8][CH:9]([CH:10]([CH2:11][OH:12])[CH2:13][OH:14])[c:15]2[c:16]([F:23])[c:17]([F:22])[cH:18][cH:19][c:20]2[F:21])[cH:6][cH:7]1.[H-:25].[Na+:24].[OH2:26]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8][CH:9]2[CH:10]([CH2:13][OH:14])[CH2:11][O:12][c:16]3[c:15]2[c:20]([F:21])[cH:19][cH:18][c:17]3[F:22])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 166653HydrideHCID 584453782-[(4-Chloro-phenylsulfanyl)-(2,3,6-trifluoro-phenyl)-methyl]-propane-1,3-diol

Product 1

HCID 67006433[4-(4-chlorophenyl)sulfanyl-5,8-difluoro-3,4-dihydro-2H-chromen-3-yl]methanol

Sources & evidence

ORD record
ord-ca4a665802284edf9c942e87386edc9d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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