3-Fluorobenzoyl chloride → HCID 57841336, compound

HRID 1558997Notes

Reaction equation

HRID 1558997 reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][NH:15][c:16]3[cH:17][c:18]4[c:19]([cH:27][cH:28]3)[O:20][C:21]([CH3:25])([CH3:26])[O:22][C:23]4=[O:24])[cH:29][cH:30]2)[cH:6][cH:7]1.[F:31][c:32]1[cH:33][c:34]([C:35](=[O:36])[Cl:37])[cH:38][cH:39][cH:40]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][N:15]([c:16]3[cH:17][c:18]4[c:19]([cH:27][cH:28]3)[O:20][C:21]([CH3:25])([CH3:26])[O:22][C:23]4=[O:24])[C:35]([c:34]3[cH:33][c:32]([F:31])[cH:40][cH:39][cH:38]3)=[O:36])[cH:29][cH:30]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 743763-Fluorobenzoyl chlorideHCID 111543016-({4-[(4-chlorophenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

Product 1

HCID 57841336HCID 57841336, compound

Sources & evidence

ORD record
ord-74f1e01a190a42cdb3e5a6df08558795
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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