Triethylamine → 3-[(Trimethylsilyl)ethynyl]benzonitrile

HRID 2160417Notes

Reaction equation

HRID 2160417 reaction equation
[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[CH3:1][Si:2]([CH3:3])([CH3:4])[C:5]#[CH:6].[CH3:23][CH2:24][O:25][C:26](=[O:27])[CH3:28].[Cu:70][I:71].[I:7][c:8]1[cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14][cH:15]1.[Pd:29]([Cl:30])[Cl:31].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1.[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[CH3:1][Si:2]([CH3:3])([CH3:4])[C:5]#[C:6][c:8]1[cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14][cH:15]1

Participants

8

Reactant 7

HCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 66111TrimethylsilylacetyleneHCID 1443413-Iodobenzonitrile

Product 1

HCID 225703183-[(Trimethylsilyl)ethynyl]benzonitrile

Sources & evidence

ORD record
ord-71394d82975f47a88c78af359b5f220a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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