Water → HCID 57619358, compound

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[cH:9][c:10]([CH2:19][N:20]([CH3:21])[CH3:22])[c:11]2[c:12]1[n:13][cH:14][c:15]([C:17]#[N:18])[cH:16]2.[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[Cl:23][C:24]([O:25][CH2:26][CH3:27])=[O:28].[OH2:29]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[cH:9][c:10]([CH2:19][Cl:23])[c:11]2[c:12]1[n:13][cH:14][c:15]([C:17]#[N:18])[cH:16]2

Participants

Reactant 4

HCID 962Water

HCID 1140Toluene

HCID 10928Ethyl chloroformate

HCID 57619406HCID 57619406, compound

Product 1

HCID 57619358HCID 57619358, compound

Sources & evidence

ORD record: ord-c4302ecebaac4b4ab521eb9753607aeb
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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