Sodium ion → Ethyl 2-(1-phenylethylamino)cyclohexane-1-carboxylate

HRID 2310635Notes

Reaction equation

HRID 2310635 reaction equation
[BH4-:7].[CH3:1][CH:2]([C:3](=[O:4])[OH:5])[CH3:6].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[Na+:8].[c:31]1([CH:37]([CH3:38])[NH:39][C:40]2=[C:41]([C:46](=[O:47])[O:48][CH2:49][CH3:50])[CH2:42][CH2:43][CH2:44][CH2:45]2)[cH:32][cH:33][cH:34][cH:35][cH:36]1.[c:9]1([CH:10]([N:11]2[CH:12]3[CH:13]([CH2:14][CH2:15][CH2:16][CH2:17]3)[CH2:18][CH:19]2[C:20]([O:21][CH2:22][CH3:23])=[O:24])[CH3:25])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[c:31]1([CH:37]([CH3:38])[NH:39][CH:40]2[CH:41]([C:46](=[O:47])[O:48][CH2:49][CH3:50])[CH2:42][CH2:43][CH2:44][CH2:45]2)[cH:32][cH:33][cH:34][cH:35][cH:36]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 1140TolueneHCID 6590Isobutyric AcidHCID 28123BorohydrideHCID 11778072Ethyl 2-(1-phenylethylamino)cyclohexene-1-carboxylateHCID 75985273Ethyl 1-(1-phenylethyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate

Product 1

HCID 20747801Ethyl 2-(1-phenylethylamino)cyclohexane-1-carboxylate

Sources & evidence

ORD record
ord-d5040a388012492f896e2161b65b021d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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