Benzene → phenyl-[4-(phenylethynyl)phenyl]methanone

HRID 1561230Notes

Reaction equation

HRID 1561230 reaction equation
[Br:27][c:28]1[cH:29][cH:30][c:31]([C:32](=[O:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41]1.[C:1]([P:2]([C:3]([CH3:4])([CH3:5])[CH3:6])[C:7]([CH3:8])([CH3:9])[CH3:10])([CH3:11])([CH3:12])[CH3:13].[CH2:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1.[CH:20]([NH:21][CH:22]([CH3:23])[CH3:24])([CH3:25])[CH3:26].[Cu:61][I:62].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[c:42]1([C:48]#[CH:49])[cH:43][cH:44][cH:45][cH:46][cH:47]1.[cH:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1>>[c:28]1([C:49]#[C:48][c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:29][cH:30][c:31]([C:32](=[O:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41]1

Participants

9

Reactant 8

HCID 241BenzeneHCID 70304-BromobenzophenoneHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 8078CyclohexaneHCID 10821PhenylacetyleneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 83681Tris(1,1-dimethylethyl)phosphine

Product 1

HCID 2179865phenyl-[4-(phenylethynyl)phenyl]methanone

Sources & evidence

ORD record
ord-06dff10697a141138335f575ccd16b6c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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