Hydrochloric Acid → HCID 22262127, compound
Reaction equation
[C:45](=[O:46])([O-:47])[OH:48].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[CH3:62][N:63]([CH3:64])[CH:65]=[O:66].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[ClH:22].[F:23][c:24]1[cH:25][cH:26][c:27]([CH:30]([CH:31]([CH2:32][c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]2)[NH2:43])[OH:44])[cH:28][cH:29]1.[Na+:49].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH2:61].[c:1]1(-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][c:3]([C:7](=[O:8])[OH:9])[cH:4][cH:5][cH:6]1>>[c:1]1(-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][c:3]([C:7](=[O:9])[NH:43][CH:31]([CH:30]([c:27]2[cH:26][cH:25][c:24]([F:23])[cH:29][cH:28]2)[OH:44])[CH2:32][c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]2)[cH:4][cH:5][cH:6]1Participants
11
Reactant 10
HCID 313Hydrochloric Acid
HCID 769Bicarbonate Ion
HCID 923Sodium ion
HCID 962Water
HCID 6228Dimethylformamide
HCID 8028Tetrahydrofuran
HCID 8857Ethyl Acetate
HCID 12854(1,1'-Biphenyl)-3-carboxylic acid
HCID 65578Oxalyl chloride
HCID 22261479(1RS,2RS)-1-(4-fluorophenyl)-1-hydroxy-3-(4-(trifluoromethyl)phenyl)-2-propylamineProduct 1
Sources & evidence
- ORD record
- ord-8acddc0a2be241c69edfd8d0cfda0230
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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