Water → 6-(2-Chloroethyl)-2H-benzo[b][1,4]oxazin-3(4H)-one

HRID 164858Notes

Reaction equation

HRID 164858 reaction equation
[CH2:23]([SiH:24]([CH2:25][CH3:26])[CH2:27][CH3:28])[CH3:29].[CH3:31][CH2:32][O:33][C:34]([CH3:35])=[O:36].[Cl:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]2[c:9]([cH:15]1)[NH:10][C:11](=[O:14])[CH2:12][O:13]2.[OH2:30].[OH:16][C:17]([C:18]([F:19])([F:20])[F:21])=[O:22]>>[Cl:1][CH2:2][CH2:3][c:5]1[cH:6][cH:7][c:8]2[c:9]([cH:15]1)[NH:10][C:11](=[O:14])[CH2:12][O:13]2

Participants

6

Reactant 5

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 12052TriethylsilaneHCID 27644586-(2-chloroacetyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

Product 1

HCID 179831346-(2-Chloroethyl)-2H-benzo[b][1,4]oxazin-3(4H)-one

Sources & evidence

ORD record
ord-178aa16fd6234de3ab1805a13b59f11c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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