Formic Acid → 5,7-di-tert-butyl-3-(4-trifluoromethyl-phenyl)-3H-benzofuran-2-one

HRID 2133925Notes

Reaction equation

HRID 2133925 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:32])[c:7]([CH:15]([c:16]2[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[N:26]2[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1.[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH:33](=[O:34])[OH:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]2[c:7]([cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1)[CH:15]([c:16]1[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]1)[C:33](=[O:34])[O:32]2

Participants

4

Reactant 3

HCID 284Formic AcidHCID 1140TolueneHCID 226483422,4-Di-tert-butyl-6-[piperidin-1-yl-(4-trifluoromethyl-phenyl)-methyl]-phenol

Product 1

HCID 121621595,7-di-tert-butyl-3-(4-trifluoromethyl-phenyl)-3H-benzofuran-2-one

Sources & evidence

ORD record
ord-1a6ab1fef9af49c28efabb7b047778c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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