Ethanol → Diethyl [3-(4-aminophenyl)propyl]malonate

HRID 1124875Notes

Reaction equation

HRID 1124875 reaction equation
[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[CH3:43][CH2:44][OH:45].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH:6]2[CH2:7][CH2:8][CH:9]([C:10]([O:11][CH3:12])=[O:13])[CH2:14]2)[cH:15][cH:16]1.[c:17]1([CH2:23][CH2:24][CH2:25][CH:26]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[NH2:1][c:20]1[cH:19][cH:18][c:17]([CH2:23][CH2:24][CH2:25][CH:26]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:22][cH:21]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 106363121,3-Diethyl 2-(3-phenylpropyl)propanedioateHCID 59464327Methyl 3-(4-aminophenyl)cyclopentanecarboxylate

Product 1

HCID 59464339Diethyl [3-(4-aminophenyl)propyl]malonate

Sources & evidence

ORD record
ord-8ceca44a3a4b4588870e5dba2ee500be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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