Acetone → HCID 68982994, compound

HRID 1140728Notes

Reaction equation

HRID 1140728 reaction equation
[Br:1][c:2]1[c:3]([OH:23])[cH:4][cH:5][c:6]2[cH:7][c:8](-[c:12]3[n:13][c:14](-[c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)[s:15][cH:16]3)[cH:9][cH:10][c:11]12.[Br:24][CH2:25][C:26]#[N:27].[C:28](=[O:29])([O-:30])[O-:31].[CH3:34][C:35](=[O:36])[CH3:37].[Cs+:32].[Cs+:33]>>[Br:1][c:2]1[c:3]([O:23][CH2:25][C:26]#[N:27])[cH:4][cH:5][c:6]2[cH:7][c:8](-[c:12]3[n:13][c:14](-[c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)[s:15][cH:16]3)[cH:9][cH:10][c:11]12

Participants

6

Reactant 5

HCID 180AcetoneHCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 68982158HCID 68982158, compound

Product 1

HCID 68982994HCID 68982994, compound

Sources & evidence

ORD record
ord-54eb2af92a4646ae9d984d9dfc21d632
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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