Nitric Acid → Methyl 5-methanesulfonyl-4-(4-nitro-3-pentafluorosulfanylphenoxy)-2-methylbenzoate

HRID 693250Notes

Reaction equation

HRID 693250 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([O:16][c:17]2[cH:18][c:19]([S:23]([F:24])([F:25])([F:26])([F:27])[F:28])[cH:20][cH:21][cH:22]2)[cH:7][c:8]([CH3:15])[c:9]([C:10](=[O:11])[O:12][CH3:13])[cH:14]1.[OH:29][N+:30]([O-:31])=[O:32]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([O:16][c:17]2[cH:18][c:19]([S:23]([F:24])([F:25])([F:26])([F:27])[F:28])[c:20]([N+:30](=[O:29])[O-:31])[cH:21][cH:22]2)[cH:7][c:8]([CH3:15])[c:9]([C:10](=[O:11])[O:12][CH3:13])[cH:14]1

Participants

3

Reactant 2

HCID 944Nitric AcidHCID 11704977Methyl 5-methanesulfonyl-2-methyl-4-(3-pentafluorosulfanylphenoxy)benzoate

Product 1

HCID 11648857Methyl 5-methanesulfonyl-4-(4-nitro-3-pentafluorosulfanylphenoxy)-2-methylbenzoate

Sources & evidence

ORD record
ord-78fc7fff9e4f42279c656f3239192918
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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