Acetic Acid → Methyl 4-(4-amino-3-pentafluorosulfanylphenoxy)-5-methanesulfonyl-2-methylbenzoate

HRID 140165Notes

Reaction equation

HRID 140165 reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([O:16][c:17]2[cH:18][c:19]([S:26]([F:27])([F:28])([F:29])([F:30])[F:31])[c:20]([N+:23]([O-:24])=[O:25])[cH:21][cH:22]2)[cH:7][c:8]([CH3:15])[c:9]([C:10](=[O:11])[O:12][CH3:13])[cH:14]1.[CH3:38][OH:39].[H:32][H:33]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([O:16][c:17]2[cH:18][c:19]([S:26]([F:27])([F:28])([F:29])([F:30])[F:31])[c:20]([NH2:23])[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

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 11648857Methyl 5-methanesulfonyl-4-(4-nitro-3-pentafluorosulfanylphenoxy)-2-methylbenzoateHCID 178418361HCID 178418361, compound

Product 1

HCID 59832568Methyl 4-(4-amino-3-pentafluorosulfanylphenoxy)-5-methanesulfonyl-2-methylbenzoate

Sources & evidence

ORD record
ord-b5f4b67b26ff411bb72cd1ab1286448e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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