Acetonitrile → HCID 58588417, compound

HRID 2345586Notes

Reaction equation

HRID 2345586 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][cH:12][cH:13]2)[cH:18][c:19]([O:21][c:22]2[n:23][cH:24][cH:25][cH:26][c:27]2-[c:28]2[n:29][c:30]([NH:34][CH3:35])[n:31][cH:32][cH:33]2)[cH:20]1.[CH3:36][C:37]#[N:38].[CH3:39][Si:40]([C:41]#[CH:42])([CH3:43])[CH3:44].[CH3:88][CH2:89][N:90]([CH2:91][CH3:92])[CH2:93][CH3:94].[Cu:86][I:87].[Pd:45]([Cl:46])[Cl:47].[c:48]1([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[cH:62][cH:63][cH:64][cH:65][cH:66]1.[c:67]1([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[cH:81][cH:82][cH:83][cH:84][cH:85]1>>[c:2]1([C:36]#[CH:37])[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][cH:12][cH:13]2)[cH:18][c:19]([O:21][c:22]2[n:23][cH:24][cH:25][cH:26][c:27]2-[c:28]2[n:29][c:30]([NH:34][CH3:35])[n:31][cH:32][cH:33]2)[cH:20]1

Participants

8

Reactant 7

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 66111TrimethylsilylacetyleneHCID 66970612HCID 66970612, compound

Product 1

HCID 58588417HCID 58588417, compound

Sources & evidence

ORD record
ord-87cb0d3a58ee4dcdbf1446bbd23638ae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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