Potassium Cation → 8-methyl-3,4-dihydro-1H-1-benzazepine-2,5-dione

HRID 2146036Notes

Reaction equation

HRID 2146036 reaction equation
[CH3:17][CH2:18][O:19][C:20]([CH3:21])=[O:22].[Cu:28][I:29].[F-:15].[I:1][c:2]1[cH:3][c:4]2[c:5]([cH:13][cH:14]1)[C:6](=[O:12])[CH2:7][CH2:8][C:9](=[O:11])[NH:10]2.[K+:16].[O:23]=[CH:24][N:25]([CH3:26])[CH3:27].[cH:30]1[cH:31][cH:32][c:33]([P:34]([Pd:35]([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[cH:105][cH:106]1>>[c:2]1([CH3:17])[cH:3][c:4]2[c:5]([cH:13][cH:14]1)[C:6](=[O:12])[CH2:7][CH2:8][C:9](=[O:11])[NH:10]2

Participants

8

Reactant 7

HCID 813Potassium CationHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 28179Fluoride IonHCID 584766238-iodo-2,3,4,5-tetrahydro-1H-1-benzazepine-2,5-dioneHCID 178420554HCID 178420554, compound

Product 1

HCID 584766398-methyl-3,4-dihydro-1H-1-benzazepine-2,5-dione

Sources & evidence

ORD record
ord-8a076219dd5e415bb469ece0aa08528e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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