Acetate → HCID 66724814, compound

HRID 196476Notes

Reaction equation

HRID 196476 reaction equation
[CH3:19][C:20](=[O:21])[O-:22].[CH3:27][C:28](=[O:29])[OH:30].[Cl:1][c:2]1[c:3]([O:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1.[N+:23](=[O:24])([O-:25])[CH3:26].[NH4+:18]>>[Cl:1][c:2]1[c:3]([O:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:4][c:5]([CH:6]=[CH:26][N+:23](=[O:24])[O-:25])[cH:8][cH:9]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 6375NitromethaneHCID 22117848HCID 22117848, compound

Product 1

HCID 66724814HCID 66724814, compound

Sources & evidence

ORD record
ord-d78c224e4a814684bb0e32e3a82bd75f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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