Tetrahydrofuran → HCID 44190037, compound

HRID 318984Notes

Reaction equation

HRID 318984 reaction equation
[Br:1][c:2]1[cH:3][n:4][c:5]([S:8][CH3:9])[n:6][cH:7]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cu:90][I:91].[Pd:49]([Cl:50])[Cl:51].[c:10]1([C:16]#[CH:17])[cH:11][cH:12][cH:13][cH:14][cH:15]1.[c:25]1([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40][cH:41][cH:42][cH:43]1.[c:52]1([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:66][cH:67][cH:68][cH:69][cH:70]1.[c:71]1([P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[cH:85][cH:86][cH:87][cH:88][cH:89]1>>[c:2]1([C:17]#[C:16][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:3][n:4][c:5]([S:8][CH3:9])[n:6][cH:7]1

Participants

8

Reactant 7

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 10821PhenylacetyleneHCID 11776Triphenylphosphine3×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 47385645-Bromo-2-(methylsulfanyl)pyrimidine

Product 1

HCID 44190037HCID 44190037, compound

Sources & evidence

ORD record
ord-8157e9aaad034ee49b8e71652853e96d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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