Acetone → HCID 68814513, compound

HRID 672266Notes

Reaction equation

HRID 672266 reaction equation
[Br:43][CH2:44][C:45]#[N:46].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9](-[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:10]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:11]2[cH:12][c:13](-[c:17]3[cH:18][cH:19][c:20]([OH:23])[cH:21][cH:22]3)[cH:14][cH:15][c:16]12.[CH3:47][C:48](=[O:49])[CH3:50].[K+:37].[K+:38].[O-:39][C:40]([O-:41])=[O:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9](-[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:10]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:11]2[cH:12][c:13](-[c:17]3[cH:18][cH:19][c:20]([O:23][CH2:44][C:45]#[N:46])[cH:21][cH:22]3)[cH:14][cH:15][c:16]12

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 68814298HCID 68814298, compound

Product 1

HCID 68814513HCID 68814513, compound

Sources & evidence

ORD record
ord-4a3131a3eaee4076a90c3d3d1eed2c2b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…