Acetonitrile → 5-(2,6-difluorophenyl)-1H-pyrrole-3-carbaldehyde

HRID 301563Notes

Reaction equation

HRID 301563 reaction equation
[CH3:16][N+:17]1([O-:23])[CH2:18][CH2:19][O:20][CH2:21][CH2:22]1.[CH3:24][C:25]#[N:26].[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([CH2:14][OH:15])[cH:12][nH:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([CH:14]=[O:15])[cH:12][nH:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 82029Methyl morpholine oxideHCID 66974511[5-(2,6-difluorophenyl)-1H-pyrrol-3-yl]methanol

Product 1

HCID 866309715-(2,6-difluorophenyl)-1H-pyrrole-3-carbaldehyde

Sources & evidence

ORD record
ord-027e27bfde1d475799f832dbd7668e61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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