Dichloromethane → Ethyl 3-(3-(2-tert-butylphenoxy)azetidin-1-yl)-3-oxopropanoate

HRID 210617

Reaction equation

HRID 210617 reaction equation
[C:16]([CH2:17][C:18](=[O:19])[OH:20])(=[O:21])[O:22][CH2:23][CH3:24].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:7][CH:8]2[CH2:9][NH:10][CH2:11]2)[cH:12][cH:13][cH:14][cH:15]1.[CH2:46]([Cl:47])[Cl:48].[CH3:25][CH2:26][N:27]=[C:28]=[N:29][CH2:30][CH2:31][CH2:32][N:33]([CH3:34])[CH3:35].[OH:36][n:37]1[c:38]2[c:39]([cH:40][cH:41][cH:42][cH:43]2)[n:44][n:45]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:7][CH:8]2[CH2:9][N:10]([C:18]([CH2:17][C:16](=[O:21])[O:22][CH2:23][CH3:24])=[O:19])[CH2:11]2)[cH:12][cH:13][cH:14][cH:15]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 70615Monoethyl malonateHCID 757711-HydroxybenzotriazoleHCID 534095303-(2-Tert-butylphenoxy)azetidine

Product 1

HCID 59577290Ethyl 3-(3-(2-tert-butylphenoxy)azetidin-1-yl)-3-oxopropanoate

Sources & evidence

ORD record
ord-e08a124f4a674292b881267e80ebc3d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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