Toluene → 1-Chloro-4-(isocyanatomethyl)benzene

HRID 286090Notes

Reaction equation

HRID 286090 reaction equation
[CH3:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[Cl:10][C:11]([Cl:12])=[O:13].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH2:7])[cH:8][cH:9]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]=[C:11]=[O:13])[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 6371PhosgeneHCID 660364-Chlorobenzylamine

Product 1

HCID 33723791-Chloro-4-(isocyanatomethyl)benzene

Sources & evidence

ORD record
ord-cdec42ae285a4ebd8d8b25c8d343ac28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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