Hydrochloric Acid → 3-Methyl-1-(4-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline

HRID 1546439

Reaction equation

HRID 1546439 reaction equation
[C:45]([O:46][BH-:47]([O:48][C:49](=[O:50])[CH3:51])[O:52][C:53](=[O:54])[CH3:55])(=[O:56])[CH3:57].[CH2:32]1[O:33][CH2:34][CH2:35][O:36][CH2:37]1.[CH3:1][O:2][C:3]([CH2:4][c:5]1[c:6]([CH:11]([NH:12][S:15]([C:16]([CH3:17])([CH3:18])[CH3:30])=[O:31])[c:19]2[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]2)[cH:7][cH:8][cH:9][cH:10]1)([O:13][CH3:14])[CH3:29].[CH:38]([O:39][CH3:40])([O:41][CH3:42])[O:43][CH3:44].[ClH:59].[Na+:58]>>[CH:3]1([CH3:29])[CH2:4][c:5]2[c:6]([cH:7][cH:8][cH:9][cH:10]2)[CH:11]([c:19]2[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]2)[NH:12]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 9005Trimethyl orthoformateHCID 312751,4-DioxaneHCID 2724942TriacetoxyborohydrideHCID 68870137N-[[2-(2,2-dimethoxypropyl)phenyl]-[4-(trifluoromethyl)phenyl]methyl]-2-methylpropane-2-sulfinamide

Product 1

HCID 595363073-Methyl-1-(4-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline

Sources & evidence

ORD record
ord-bd2676c27408407080096f18af05a6a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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