Toluene → HCID 69743557, compound

HRID 299126Notes

Reaction equation

HRID 299126 reaction equation
[C-:42]#[N:43].[C-:45]#[N:46].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([C:25](=[O:26])[O:27][CH2:28][CH3:29])[N:7]([c:11]2[cH:12][n:13][c:14]([O:17][c:18]3[cH:19][cH:20][c:21]([Br:24])[cH:22][cH:23]3)[cH:15][cH:16]2)[CH2:8][CH2:9][CH2:10]1.[CH3:30][N:31]([CH3:32])[CH:33]=[O:34].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Zn+2:44]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([C:25](=[O:26])[O:27][CH2:28][CH3:29])[N:7]([c:11]2[cH:12][n:13][c:14]([O:17][c:18]3[cH:19][cH:20][c:21]([C:30]#[N:31])[cH:22][cH:23]3)[cH:15][cH:16]2)[CH2:8][CH2:9][CH2:10]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 5975Cyanide2×HCID 6228DimethylformamideHCID 32051Zinc(2+)HCID 12133937HCID 12133937, compound

Product 1

HCID 69743557HCID 69743557, compound

Sources & evidence

ORD record
ord-f8dd5d6ca69b468fbec3f37d6c24c82f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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