Trifluoroacetic acid → Trifluoroacetic acid

HRID 87710Notes

Reaction equation

HRID 87710 reaction equation
[Cl:39][c:40]1[cH:41][c:42]2[c:43]([c:44]([CH:45]([O:46][CH2:47][C:48]3([c:49]4[cH:50][cH:51][c:52]([F:53])[cH:54][cH:55]4)[CH2:56][CH2:57][N:58]([C:59]([O:60][C:61]([CH3:62])([CH3:63])[CH3:64])=[O:65])[CH2:66][CH2:67]3)[CH2:68][OH:69])[cH:70]1)[nH:71][n:72][cH:73]2.[Cl:8][c:9]1[cH:10][c:11]2[cH:12][n:13][nH:14][c:15]2[c:16]([CH:18]([C:19](=[O:20])[O:21][CH3:22])[O:23][CH2:24][C:25]2([c:32]3[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]3)[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]2)[cH:17]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]>>[Cl:8][c:9]1[cH:10][c:11]2[cH:12][n:13][nH:14][c:15]2[c:16]([CH:18]([CH2:19][OH:20])[O:23][CH2:24][C:25]2([c:32]3[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]3)[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]2)[cH:17]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]

Participants

5

Reactant 3

HCID 6422Trifluoroacetic acidHCID 57545991HCID 57545991, compoundHCID 57546047methyl 2-(5-chloro-1H-indazol-7-yl)-2-[[4-(4-fluorophenyl)-1-methylpiperidin-4-yl]methoxy]acetate

Product 2

HCID 6422Trifluoroacetic acidHCID 575459712-(5-chloro-1H-indazol-7-yl)-2-[[4-(4-fluorophenyl)-1-methylpiperidin-4-yl]methoxy]ethanol

Sources & evidence

ORD record
ord-e84ea8445c8843d6867c88ba1de192d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…