Water → 4'-Chloro-2-biphenylylisothiocyanate

Reaction equation

[Cl:15][C:16]([Cl:17])=[S:18].[NH2:1][c:2]1[c:3](-[c:8]2[cH:9][cH:10][c:11]([Cl:14])[cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1.[O:19]1[CH2:20][CH2:21][O:22][CH2:23][CH2:24]1.[OH2:25]>>[N:1]([c:2]1[c:3](-[c:8]2[cH:9][cH:10][c:11]([Cl:14])[cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1)=[C:16]=[S:18]

Participants

Reactant 4

HCID 962Water

HCID 10040Thiophosgene

HCID 312751,4-Dioxane

HCID 2622612-Amino-4'-chlorobiphenyl

Product 1

HCID 190892634'-Chloro-2-biphenylylisothiocyanate

Sources & evidence

ORD record: ord-ee2fe5fae6ee41069217b17910447da0
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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