Benzene → HCID 21099420, compound

HRID 137982

Reaction equation

HRID 137982 reaction equation
[Br:10][c:11]1[cH:12][cH:13][c:14]([S:17](=[O:18])[O-:19])[cH:15][cH:16]1.[Br:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][cH:8][cH:9]1.[CH3:21][N:22]([CH3:23])[CH2:24][CH2:25][NH2:26].[CH3:28][S:29]([CH3:30])=[O:31].[Cu+:46].[F:38][C:39]([F:40])([F:41])[S:42]([O-:43])(=[O:44])=[O:45].[Na+:20].[OH2:27].[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[c:2]1([S:17]([c:14]2[cH:13][cH:12][c:11]([Br:10])[cH:16][cH:15]2)(=[O:18])=[O:19])[c:3]([CH:4]=[O:5])[cH:6][cH:7][cH:8][cH:9]1

Participants

10

Reactant 9

HCID 241BenzeneHCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962WaterHCID 66053N,N-DimethylethylenediamineHCID 811292-BromobenzaldehydeHCID 104815Copper(1+)HCID 2758875TrifluoromethanesulfonateHCID 3767219CID 3767219

Product 1

HCID 21099420HCID 21099420, compound

Sources & evidence

ORD record
ord-f34bfde39c79456890c9ac0e1e935c39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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