Acetonitrile → HCID 58707301, compound

HRID 135008Notes

Reaction equation

HRID 135008 reaction equation
[CH3:30][C:31]#[N:32].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:12][c:13]1[cH:14][c:15]([CH2:16][NH2:17])[cH:18][cH:19][cH:20]1.[F:1][c:2]1[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[c:2]1([NH:17][CH2:16][c:15]2[cH:14][c:13]([Cl:12])[cH:20][cH:19][cH:18]2)[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 679672,4-DifluoronitrobenzeneHCID 77802Benzenemethanamine, 3-chloro-HCID 81531Diisopropylethylamine

Product 1

HCID 58707301HCID 58707301, compound

Sources & evidence

ORD record
ord-c46ecd773d184f9eae02ccbaccdc40b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…