Toluene → ethyl 8-(phenylethynyl)-6-(trifluoromethoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

HRID 176794Notes

Reaction equation

HRID 176794 reaction equation
[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cu:41][I:42].[I:1][c:2]1[cH:3][c:4]([O:21][C:22]([F:23])([F:24])[F:25])[cH:5][c:6]2[c:11]1[O:10][CH:9]([C:12]([F:13])([F:14])[F:15])[C:8]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:7]2.[c:26]1([C:32]#[CH:33])[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[c:2]1([C:33]#[C:32][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:3][c:4]([O:21][C:22]([F:23])([F:24])[F:25])[cH:5][c:6]2[c:11]1[O:10][CH:9]([C:12]([F:13])([F:14])[F:15])[C:8]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:7]2

Participants

5

Reactant 4

HCID 1140TolueneHCID 10821PhenylacetyleneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 86599457ethyl 8-iodo-6-(trifluoromethoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

Product 1

HCID 86599458ethyl 8-(phenylethynyl)-6-(trifluoromethoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

Sources & evidence

ORD record
ord-9251db8da83c4c02ace13ae41715ff72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…