Acetic Acid → 2,6-Bis(1,1-dimethylethyl)-4-[[5-(methylsulfinyl)-1,3,4-thiadiazol-2-yl]thio]-phenol

HRID 1563984Notes

Reaction equation

HRID 1563984 reaction equation
[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[c:6]([OH:23])[c:7]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:8][c:9]([S:11][c:12]2[s:13][c:14]([S:17][CH3:18])[n:15][n:16]2)[cH:10]1.[CH3:36][C:37](=[O:38])[OH:39].[Na+:24].[Na+:25].[OH:26][B-:27]1([OH:35])[O:28][O:29][B-:30]([OH:31])([OH:32])[O:33][O:34]1>>[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[c:6]([OH:23])[c:7]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:8][c:9]([S:11][c:12]2[s:13][c:14]([S:17]([CH3:18])=[O:26])[n:15][n:16]2)[cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 5460515Perborate(2-)HCID 199006582,6-Bis(1,1-dimethylethyl)-4-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]phenol

Product 1

HCID 199006572,6-Bis(1,1-dimethylethyl)-4-[[5-(methylsulfinyl)-1,3,4-thiadiazol-2-yl]thio]-phenol

Sources & evidence

ORD record
ord-75618186dc7b4425aed383e1ed165fe2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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