Tetrahydrofuran → HCID 58100142, compound

HRID 180322Notes

Reaction equation

HRID 180322 reaction equation
[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[O:37][C:38]([NH:39][CH2:40][CH2:41][C:42]#[CH:43])=[O:44].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cu:50][I:51].[I:8][c:9]1[cH:10][cH:11][c:12]([C:15]#[C:16][CH2:17][CH2:18][N:19]2[C:20](=[O:29])[c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[C:27]2=[O:28])[cH:13][cH:14]1.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[Pd:52]([Cl:53])[Cl:54].[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1.[c:74]1([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[cH:88][cH:89][cH:90][cH:91][cH:92]1>>[c:9]1([C:43]#[C:42][CH2:41][CH2:40][NH:39][C:38]([O:37][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:44])[cH:10][cH:11][c:12]([C:15]#[C:16][CH2:17][CH2:18][N:19]2[C:20](=[O:29])[c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[C:27]2=[O:28])[cH:13][cH:14]1

Participants

8

Reactant 7

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 21185506HCID 21185506, compoundHCID 58100104HCID 58100104, compound

Product 1

HCID 58100142HCID 58100142, compound

Sources & evidence

ORD record
ord-09dcc8a94c5f4930aaa6172a3ad252b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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