Acetonitrile → Methyl 6-amino-5-bromo-3-fluoropicolinate

HRID 2326685Notes

Reaction equation

HRID 2326685 reaction equation
[B-:13]([F:14])([F:15])([F:16])[F:17].[B-:18]([F:19])([F:20])([F:21])[F:22].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][c:7]([NH2:12])[c:8]([Br:11])[cH:9][cH:10]1.[CH3:34][C:35]#[N:36].[Cl:23][CH2:24][N+:25]12[CH2:26][CH2:27][N+:28]([F:29])([CH2:30][CH2:31]1)[CH2:32][CH2:33]2>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][c:7]([NH2:12])[c:8]([Br:11])[cH:9][c:10]1[F:14]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 26255Tetrafluoroborate2×HCID 27249341-(Chloromethyl)-4-fluoro-1,4-diazoniabicyclo(2.2.2)octaneHCID 10704661Methyl 6-amino-5-bromopicolinate

Product 1

HCID 21873678Methyl 6-amino-5-bromo-3-fluoropicolinate

Sources & evidence

ORD record
ord-8a90b72b27454cfb9e1c665ac4f167c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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