Toluene → 2-(4-Bromophenyl)chroman-4-one

HRID 1546484Notes

Reaction equation

HRID 1546484 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:8]=[C:9]([C:10]([O:11][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[C:17](=[O:18])[c:19]2[c:20]([OH:25])[cH:21][cH:22][cH:23][cH:24]2)[cH:6][cH:7]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[NH2:37][C:38](=[S:39])[NH2:40].[c:26]1([CH3:27])[cH:28][cH:29][c:30]([S:31]([OH:32])(=[O:33])=[O:34])[cH:35][cH:36]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][C:17](=[O:18])[c:19]3[c:20]([cH:21][cH:22][cH:23][cH:24]3)[O:25]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 2723790ThioureaHCID 67203308Tert-butyl 3-(4-bromophenyl)-2-(2-hydroxybenzoyl)prop-2-enoate

Product 1

HCID 52715332-(4-Bromophenyl)chroman-4-one

Sources & evidence

ORD record
ord-8e86018b66a4453494ed756e1604b33c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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