Acetic Acid → 2,6-Di-tert-butyl-4-nitrophenol

HRID 291471Notes

Reaction equation

HRID 291471 reaction equation
[C:16]([OH:17])(=[O:18])[CH3:19].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:15])[c:7]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:8][cH:9][cH:10]1.[CH2:24]1[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]1.[N+:20](=[O:21])([OH:22])[O-:23]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:15])[c:7]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:8][c:9]([N+:20](=[O:21])[O-:22])[cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 944Nitric AcidHCID 8078CyclohexaneHCID 314052,6-Di-tert-butylphenol

Product 1

HCID 697652,6-Di-tert-butyl-4-nitrophenol

Sources & evidence

ORD record
ord-f2d6eb77e2b04b00b9850e47fada7a91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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