Methanol → Trifluoroacetic acid

HRID 188130Notes

Reaction equation

HRID 188130 reaction equation
[CH3:40][OH:41].[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[OH:8][c:9]1[c:10]([CH:18]=[CH:19][CH:20]2[N:21]([C:25]([c:26]3[cH:27][cH:28][c:29](-[c:32]4[cH:33][nH:34][c:35](=[O:38])[cH:36][cH:37]4)[cH:30][cH:31]3)=[O:39])[CH2:22][CH2:23][CH2:24]2)[cH:11][c:12]([C:13](=[NH:14])[NH2:15])[cH:16][cH:17]1>>[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[OH:8][c:9]1[c:10]([CH2:18][CH2:19][CH:20]2[N:21]([C:25]([c:26]3[cH:27][cH:28][c:29](-[c:32]4[cH:33][nH:34][c:35](=[O:38])[cH:36][cH:37]4)[cH:30][cH:31]3)=[O:39])[CH2:22][CH2:23][CH2:24]2)[cH:11][c:12]([C:13](=[NH:14])[NH2:15])[cH:16][cH:17]1

Participants

5

Reactant 3

HCID 887MethanolHCID 6422Trifluoroacetic acidHCID 178512057HCID 178512057, compound

Product 2

HCID 6422Trifluoroacetic acidHCID 135423111HCID 135423111, compound

Sources & evidence

ORD record
ord-afc04c13c1964b558436f1660caf9253
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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