Ethanol → Methyl 3-(3-aminopropoxy)benzoate

HRID 683268Notes

Reaction equation

HRID 683268 reaction equation
[CH2:17]([O:18][C:19](=[O:20])[NH:27][CH2:28][CH2:29][CH2:30][O:31][c:32]1[cH:33][c:34]([C:35](=[O:36])[O:37][CH3:38])[cH:39][cH:40][cH:41]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[CH3:42][CH2:43][OH:44].[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[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>>[NH2:27][CH2:28][CH2:29][CH2:30][O:31][c:32]1[cH:33][c:34]([C:35](=[O:36])[O:37][CH3:38])[cH:39][cH:40][cH:41]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 59464327Methyl 3-(4-aminophenyl)cyclopentanecarboxylateHCID 59464335Methyl 3-(3-{[(benzyloxy)carbonyl]amino}propoxy)benzoate

Product 1

HCID 59464150Methyl 3-(3-aminopropoxy)benzoate

Sources & evidence

ORD record
ord-e5d658398d0945cdb96fcdf62fbd6ac3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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