Nitric Acid → 3,4-Dimethyl-2,6-dinitrophenol

HRID 2318306Notes

Reaction equation

HRID 2318306 reaction equation
[CH3:5][c:6]1[c:7]([CH3:8])[cH:9][c:10]([OH:11])[cH:12][cH:13]1.[Cl:38][CH2:39][Cl:40].[N+:14](=[O:15])([O-:16])[c:17]1[c:18]([OH:25])[cH:19][cH:20][c:21]([CH3:24])[c:22]1[CH3:23].[N+:26]([C:27]1([CH3:28])[CH:29]=[CH:30][C:31]([OH:32])=[CH:33][CH:34]1[CH3:35])([O-:36])=[O:37].[OH:1][N+:2]([O-:3])=[O:4]>>[O:1]=[N+:2]([O-:3])[c:19]1[c:18]([OH:25])[c:17]([N+:14](=[O:15])[O-:16])[c:22]([CH3:23])[c:21]([CH3:24])[cH:20]1

Participants

6

Reactant 5

HCID 944Nitric AcidHCID 6344DichloromethaneHCID 72493,4-DimethylphenolHCID 135714543,4-Dimethyl-2-nitrophenolHCID 676509804-Nitro-3,4-xylenol

Product 1

HCID 3491273,4-Dimethyl-2,6-dinitrophenol

Sources & evidence

ORD record
ord-29a09f83998744e89262246abc6e75fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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