Acetate → Benzene, 1-(2-nitroethenyl)-3-phenoxy-

HRID 1556002Notes

Reaction equation

HRID 1556002 reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:25][C:26](=[O:27])[O-:28].[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[N+:20](=[O:21])([O-:22])[CH3:23].[NH4+:24].[O:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[c:12]1[cH:13][c:14]([CH:15]=[O:16])[cH:17][cH:18][cH:19]1.[OH2:35]>>[O:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[c:12]1[cH:13][c:14]([CH:15]=[CH:23][N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]1

Participants

8

Reactant 7

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 962WaterHCID 6375NitromethaneHCID 8857Ethyl AcetateHCID 382843-Phenoxybenzaldehyde

Product 1

HCID 2732974Benzene, 1-(2-nitroethenyl)-3-phenoxy-

Sources & evidence

ORD record
ord-25068ad4c0a3405cb61ebd5fc33a43c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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