1,1-Dichloroethane → 2-(4-Fluorophenyl)acetyl isocyanate

HRID 108252Notes

Reaction equation

HRID 108252 reaction equation
[Cl:12][C:13]([C:14]([Cl:15])=[O:16])=[O:17].[Cl:33][CH:34]([Cl:35])[CH3:36].[F:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][C:26](=[O:27])[NH:28][C:29]([O:30][CH3:32])=[O:31])[cH:23][cH:24]1.[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][C:7]([NH2:8])=[O:9])[cH:10][cH:11]1>>[F:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][C:26](=[O:27])[N:28]=[C:29]=[O:30])[cH:23][cH:24]1

Participants

5

Reactant 4

HCID 63651,1-DichloroethaneHCID 65578Oxalyl chlorideHCID 5731202-(4-Fluorophenyl)acetamideHCID 21081725Methyl 2-(4-fluorophenyl)acetylcarbamate

Product 1

HCID 231530882-(4-Fluorophenyl)acetyl isocyanate

Sources & evidence

ORD record
ord-b23ad7bd0444402599760f7aa37feb40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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