Trifluoroacetic acid → Trifluoroacetic acid

HRID 1209903Notes

Reaction equation

HRID 1209903 reaction equation
[F:41][C:42]([C:43](=[O:44])[OH:45])([F:46])[F:47].[c:1]1(-[c:7]2[c:8](-[c:18]3[n:19][c:20](-[c:23]4[cH:24][cH:25][c:26]([CH2:27][N:28]5[CH2:29][CH:30]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:31]5)[cH:39][cH:40]4)[n:21][o:22]3)[n:9][o:10][c:11]2-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[F:41][C:42]([C:43](=[O:44])[OH:45])([F:46])[F:47].[c:1]1(-[c:7]2[c:8](-[c:18]3[n:19][c:20](-[c:23]4[cH:24][cH:25][c:26]([CH2:27][N:28]5[CH2:29][CH:30]([C:32](=[O:33])[OH:34])[CH2:31]5)[cH:39][cH:40]4)[n:21][o:22]3)[n:9][o:10][c:11]2-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 2

HCID 6422Trifluoroacetic acidHCID 58537217Tert-butyl 1-(4-(5-(4,5-diphenylisoxazol-3-yl)-1,2,4-oxadiazol-3-yl)benzyl)azetidine-3-carboxylate

Product 2

HCID 6422Trifluoroacetic acidHCID 468469121-[[4-[5-(4,5-Diphenyl-1,2-oxazol-3-yl)-1,2,4-oxadiazol-3-yl]phenyl]methyl]azetidine-3-carboxylic acid

Sources & evidence

ORD record
ord-b962fabd476e44acaaaf550e29ac3128
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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