Acetonitrile → HCID 178526240, compound

HRID 1202067Notes

Reaction equation

HRID 1202067 reaction equation
[CH3:29][C:30]#[N:31].[Cl:18][c:19]1[cH:20][cH:21][cH:22][c:23]([C:24]([O:25][OH:27])=[O:26])[cH:28]1.[c:1]1([CH2:7][CH2:8][c:9]2[cH:10][c:11]3[c:12]([n:13][cH:14][cH:15][cH:16]3)[nH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][c:9]2[cH:10][c:11]3[c:12]([n+:13]([O-:26])[cH:14][cH:15][cH:16]3)[nH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 70297m-Chloroperbenzoic acidHCID 68663939HCID 68663939, compound

Product 1

HCID 178526240HCID 178526240, compound

Sources & evidence

ORD record
ord-907648c4f89d485f979d457861635ba2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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