Benzene → HCID 53775559, compound

HRID 1556594Notes

Reaction equation

HRID 1556594 reaction equation
[CH3:19][C:20]([O:21][C:22](=[O:23])[CH3:24])=[O:25].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][S:6][c:7]1[c:8]([CH:13]=[N:14][CH2:15][CH2:16][CH2:17][CH3:18])[cH:9][cH:10][cH:11][cH:12]1.[N+:26](=[O:27])([O-:28])[CH2:29][C:30]([CH3:31])=[O:32].[cH:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][S:6][c:7]1[c:8]([CH:13]=[C:29]([N+:26](=[O:27])[O-:28])[C:30]([CH3:31])=[O:32])[cH:9][cH:10][cH:11][cH:12]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 7918Acetic AnhydrideHCID 662962-Propanone, 1-nitro-HCID 19023626HCID 19023626, compound

Product 1

HCID 53775559HCID 53775559, compound

Sources & evidence

ORD record
ord-5e8c6c216e8d424490d464ee327ef0c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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