2-Methoxyethanol → 1-(4-Amino-phenyl)-3-decyl-3-aza-bicyclo[3.1.1]heptane-2,4-dione

HRID 99138Notes

Reaction equation

HRID 99138 reaction equation
[C:35]([O:36][CH2:37][CH3:38])(=[O:39])[CH3:40].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[N:11]1[C:12](=[O:28])[C:13]2([c:19]3[cH:20][cH:21][c:22]([N+:25]([O-:26])=[O:27])[cH:23][cH:24]3)[CH2:14][CH:15]([C:16]1=[O:17])[CH2:18]2.[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:41][O:42][CH2:43][CH2:44][OH:45]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[N:11]1[C:12](=[O:28])[C:13]2([c:19]3[cH:20][cH:21][c:22]([NH2:25])[cH:23][cH:24]3)[CH2:14][CH:15]([C:16]1=[O:17])[CH2:18]2

Participants

5

Reactant 4

HCID 80192-MethoxyethanolHCID 8058HexaneHCID 8857Ethyl AcetateHCID 148726163-n-Decyl-1-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione

Product 1

HCID 148726231-(4-Amino-phenyl)-3-decyl-3-aza-bicyclo[3.1.1]heptane-2,4-dione

Sources & evidence

ORD record
ord-fc4466b38d7448a9aa864c28547e7ab8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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