Cyclohexanecarbonyl chloride → HCID 57841375, compound

HRID 1117286Notes

Reaction equation

HRID 1117286 reaction equation
[CH:31]1([C:37](=[O:38])[Cl:39])[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]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][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>>[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:37]([CH:31]3[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]3)=[O:38])[cH:29][cH:30]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 75938Cyclohexanecarbonyl chlorideHCID 111543016-({4-[(4-chlorophenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

Product 1

HCID 57841375HCID 57841375, compound

Sources & evidence

ORD record
ord-b55116cc3b354402a016d96491a31593
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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