Ethanol → Trifluoroacetic acid

HRID 297229Notes

Reaction equation

HRID 297229 reaction equation
[CH2:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[O:15][CH2:16][CH:17]1[N:18]([C:41]([CH:42]([CH2:43][CH:44]([CH3:45])[CH3:46])[OH:47])=[O:48])[CH2:19][CH2:20][N:21]([c:23]2[n:24][c:25](-[c:34]3[c:35]([OH:40])[cH:36][cH:37][cH:38][cH:39]3)[n:26][c:27]3[cH:28][c:29]([CH3:33])[cH:30][cH:31][c:32]23)[CH2:22]1.[CH3:49][CH2:50][OH:51].[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[OH-:52].[OH-:53].[Pd+2:54]>>[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[OH:15][CH2:16][CH:17]1[N:18]([C:41]([CH:42]([CH2:43][CH:44]([CH3:45])[CH3:46])[OH:47])=[O:48])[CH2:19][CH2:20][N:21]([c:23]2[n:24][c:25](-[c:34]3[c:35]([OH:40])[cH:36][cH:37][cH:38][cH:39]3)[n:26][c:27]3[cH:28][c:29]([CH3:33])[cH:30][cH:31][c:32]23)[CH2:22]1

Participants

7

Reactant 5

HCID 702EthanolHCID 961Hydroxide2×HCID 6422Trifluoroacetic acidHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 136366679HCID 136366679, compound

Product 2

HCID 6422Trifluoroacetic acidHCID 136366899HCID 136366899, compound

Sources & evidence

ORD record
ord-7723b4210454406daa34a5e2439d69cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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