Acetonitrile → Trifluoroacetic acid

HRID 1208598Notes

Reaction equation

HRID 1208598 reaction equation
[CH2:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[O:15][C:16](=[O:17])[NH:18][CH:19]([C:20](=[O:21])[NH:22][CH:23]([CH:24]([CH3:25])[CH3:26])[P:27](=[O:28])([O:29][CH:30]([C:31](=[O:32])[OH:33])[CH2:34][CH2:35][CH2:36][NH:37][C:38]([O:39][C:40]([CH3:41])([CH3:42])[CH3:43])=[O:44])[OH:45])[CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:53][C:54]#[N:55].[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]>>[CH2:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[O:15][C:16](=[O:17])[NH:18][CH:19]([C:20](=[O:21])[NH:22][CH:23]([CH:24]([CH3:25])[CH3:26])[P:27](=[O:28])([O:29][CH:30]([C:31](=[O:32])[OH:33])[CH2:34][CH2:35][CH2:36][NH2:37])[OH:45])[CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 571114642-{[1-(2-Benzyloxycarbonylamino-3-phenyl-propionylamino)-2-methyl-propyl]-hydroxy-phosphinoyloxy}-5-tert-butoxycarbonylamino-pentanoic acid

Product 2

HCID 6422Trifluoroacetic acidHCID 17904704HCID 17904704, compound

Sources & evidence

ORD record
ord-d82c554e723e4af9bbf01c8f78c91191
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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