Hexane → Cyclopropyl-methyl-(3-trimethylsilanylethynyl-phenyl)-amine

HRID 2149181Notes

Reaction equation

HRID 2149181 reaction equation
[Br:1][c:2]1[cH:3][c:4]([N:8]([CH3:9])[CH:10]2[CH2:11][CH2:12]2)[cH:5][cH:6][cH:7]1.[CH2:13]([N:14]([CH2:15][CH3:16])[CH2:17][CH3:18])[CH3:19].[CH3:20][Si:21]([CH3:22])([CH3:23])[C:24]#[CH:25].[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[Cu:38][I:39].[Pd:40]([Cl:41])[Cl:42].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1.[c:62]1([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[c:2]1([C:25]#[C:24][Si:21]([CH3:20])([CH3:22])[CH3:23])[cH:3][c:4]([N:8]([CH3:9])[CH:10]2[CH2:11][CH2:12]2)[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 8058HexaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 66111TrimethylsilylacetyleneHCID 21107154(3-Bromo-phenyl)-cyclopropyl-methyl-amine

Product 1

HCID 57424251Cyclopropyl-methyl-(3-trimethylsilanylethynyl-phenyl)-amine

Sources & evidence

ORD record
ord-9a2c5d15e66d4a89a37cb0fac7d92848
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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