Water → Trifluoroacetate

HRID 1150627Notes

Reaction equation

HRID 1150627 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([O:28][CH3:29])[cH:30][cH:31][c:32]1[CH2:33][N:6]1[CH2:7][c:8]2[c:9](-[c:19]3[cH:20][cH:21][c:22]([CH2:25][NH:26][CH3:27])[cH:23][cH:24]3)[n:10][c:11]3[cH:12][cH:13][cH:14][c:15]([n:18]23)[C:16]1=[O:17].[F:35][C:36]([C:37](=[O:38])[OH:39])([F:40])[F:41].[OH2:34]>>[F:35][C:36]([C:37](=[O:38])[O-:39])([F:40])[F:41].[NH:6]1[CH2:7][c:8]2[c:9](-[c:19]3[cH:20][cH:21][c:22]([CH2:25][NH2+:26][CH3:27])[cH:23][cH:24]3)[n:10][c:11]3[cH:12][cH:13][cH:14][c:15]([n:18]23)[C:16]1=[O:17]

Participants

5

Reactant 3

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 68634168HCID 68634168, compound

Product 2

HCID 84468TrifluoroacetateHCID 178486206HCID 178486206, compound

Sources & evidence

ORD record
ord-fdd2190c4dbd4f688a9b7baedc16abcd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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