Bromide ion → 6-bromo-3-(4-methylphenyl)-2H-1-benzopyran

HRID 1233693Notes

Reaction equation

HRID 1233693 reaction equation
[Br-:1].[Br:2][c:3]1[cH:4][cH:5][c:6]([O:29][CH2:30][C:31](=[O:9])[c:33]2[cH:34][cH:35][c:36]([CH3:39])[cH:37][cH:38]2)[c:7]([CH2:8][P+:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:32]2)[cH:28]1.[CH3:41][CH2:42][O-:43].[CH3:45][CH2:46][OH:47].[Na+:40].[OH2:44]>>[Br:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:28]1)[CH:8]=[C:31]([c:33]1[cH:34][cH:35][c:36]([CH3:39])[cH:37][cH:38]1)[CH2:30][O:29]2

Participants

7

Reactant 6

HCID 259Bromide ionHCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 1194401-Hydroxyethyl radicalHCID 86759183[5-Bromo-2-[2-(4-methylphenyl)-2-oxoethoxy]phenyl]methyl-triphenylphosphanium

Product 1

HCID 229901326-bromo-3-(4-methylphenyl)-2H-1-benzopyran

Sources & evidence

ORD record
ord-1d04c941ba444599b36a29b55d1cf15c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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