Chloride → methyl N-[5-(3,3-dimethyl-1-butynyl)-2-fluorobenzyl]carbamate

HRID 95742Notes

Reaction equation

HRID 95742 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([F:14])[c:6]([CH2:7][NH:8][C:9]([O:10][CH3:11])=[O:12])[cH:13]1.[CH3:15][C:16]([C:17]#[CH:18])([CH3:19])[CH3:20].[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:32][N:33]([CH3:34])[CH:35]=[O:36].[Cl-:29].[Cu:30][I:31].[Na+:28]>>[c:2]1([C:18]#[C:17][C:16]([CH3:15])([CH3:19])[CH3:20])[cH:3][cH:4][c:5]([F:14])[c:6]([CH2:7][NH:8][C:9]([O:10][CH3:11])=[O:12])[cH:13]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 923Sodium ionHCID 6228DimethylformamideHCID 8471TriethylamineHCID 135123,3-Dimethyl-1-butyneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 15483912methyl N-(5-bromo-2-fluorobenzyl)carbamate

Product 1

HCID 15483913methyl N-[5-(3,3-dimethyl-1-butynyl)-2-fluorobenzyl]carbamate

Sources & evidence

ORD record
ord-539156a94580400eb2c55607f6d15d32
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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