Ethyl Acetate → HCID 68470303, compound

HRID 2330187Notes

Reaction equation

[Br:1][c:2]1[cH:3][c:4]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[s:5][c:6]1[NH:7][C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[CH:20]([N:21]([CH2:22][CH3:23])[CH:24]([CH3:25])[CH3:26])([CH3:27])[CH3:28].[Cu:43][I:44].[c:29]1([C:35]#[CH:36])[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[c:2]1([C:36]#[C:35][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:3][c:4]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[s:5][c:6]1[NH:7][C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14]

Participants

Reactant 5

HCID 8857Ethyl Acetate

HCID 10821Phenylacetylene

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

HCID 81531Diisopropylethylamine

HCID 25258090HCID 25258090, compound

Product 1

HCID 68470303HCID 68470303, compound

Sources & evidence

ORD record: ord-98350457b87a4f589906778a3ad77275
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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