Acetic Acid → 6-methoxy-2,2-dimethyl-7-nitro-2H-1-benzopyran

HRID 2139351Notes

Reaction equation

HRID 2139351 reaction equation
[CH3:1][C:2]([O:3][C:4](=[O:5])[CH3:6])=[O:7].[CH3:28][C:29](=[O:30])[OH:31].[CH3:8][O:9][c:10]1[cH:11][cH:12][c:13]2[c:14]([cH:21]1)[CH:15]=[CH:16][C:17]([CH3:19])([CH3:20])[O:18]2.[Na+:27].[OH-:26].[OH:22][N+:23]([O-:24])=[O:25]>>[CH3:8][O:9][c:10]1[c:11]([N+:23](=[O:22])[O-:24])[cH:12][c:13]2[c:14]([cH:21]1)[CH:15]=[CH:16][C:17]([CH3:19])([CH3:20])[O:18]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 944Nitric AcidHCID 961HydroxideHCID 7918Acetic AnhydrideHCID 117454246-Methoxy-2,2-dimethyl-2H-1-benzopyran

Product 1

HCID 591343256-methoxy-2,2-dimethyl-7-nitro-2H-1-benzopyran

Sources & evidence

ORD record
ord-ee4c2ba6ac084269aa88124d8bcefa77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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