Acetic Acid → 5-Methyl-6-nitro-1,3-benzodioxole

HRID 2333944

Reaction equation

HRID 2333944 reaction equation
[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH3:10])[cH:6][cH:7][c:8]2[O:9]1.[CH3:15][C:16](=[O:17])[OH:18].[OH:11][N+:12]([O-:13])=[O:14]>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH3:10])[c:6]([N+:12](=[O:11])[O-:13])[cH:7][c:8]2[O:9]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 944Nitric AcidHCID 815641,3-Benzodioxole, 5-methyl-

Product 1

HCID 45504615-Methyl-6-nitro-1,3-benzodioxole

Sources & evidence

ORD record
ord-c0f3bd473fa54b67922a09479d0eb9dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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