Cyanide → HCID 68679591, compound

HRID 1225703Notes

Reaction equation

HRID 1225703 reaction equation
[Br:1][c:2]1[cH:3][c:4]([N:17]=[c:18]2[s:19][cH:20][cH:21][n:22]2[CH2:23][O:24][CH3:25])[n:5][c:6]([CH2:8][O:9][Si:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[CH3:16])[cH:7]1.[C-:80]#[N:81].[C-:83]#[N:84].[CH3:68][N:69]([CH3:70])[C:71](=[O:72])[CH3:73].[CH3:74][CH2:75][O:76][C:77](=[O:78])[CH3:79].[Zn+2:82].[Zn:85].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[c:35]3[c:59]([cH:60][cH:61][cH:62]2)[C:56]([CH3:57])([CH3:58])[c:38]2[c:37]([c:42]([P:43]([c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:41][cH:40][cH:39]2)[O:36]3)[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[c:2]1([C:68]#[N:69])[cH:3][c:4]([N:17]=[c:18]2[s:19][cH:20][cH:21][n:22]2[CH2:23][O:24][CH3:25])[n:5][c:6]([CH2:8][O:9][Si:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[CH3:16])[cH:7]1

Participants

8

Reactant 7

HCID 5975Cyanide2×HCID 8857Ethyl AcetateHCID 23994ZincHCID 31374DimethylacetamideHCID 32051Zinc(2+)HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 68679187HCID 68679187, compound

Product 1

HCID 68679591HCID 68679591, compound

Sources & evidence

ORD record
ord-e6b015dd36764d0bb9d1f8a0a7495990
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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