1-Butanol → Ethyl 4-(3-Piperidin-1-ylpropoxy)benzoate

HRID 294887Notes

Reaction equation

HRID 294887 reaction equation
[CH2:17]1[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]1.[CH2:31]([OH:32])[CH2:33][CH2:34][CH3:35].[CH3:36][CH2:37][O:38][C:39]([CH3:40])=[O:41].[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[cH:15][cH:16]1.[I-:30].[K+:29].[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[cH:15][cH:16]1)[N:20]1[CH2:19][CH2:18][CH2:17][CH2:22][CH2:21]1

Participants

9

Reactant 8

HCID 2631-ButanolHCID 813Potassium CationHCID 923Sodium ion2×HCID 8082PiperidineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 30165Iodide IonHCID 18348522Ethyl 4-(3-chloropropoxy)benzoate

Product 1

HCID 17986307Ethyl 4-(3-Piperidin-1-ylpropoxy)benzoate

Sources & evidence

ORD record
ord-dbb1d7ea85534b3fb3e59702d8e8acdc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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