Water → Tert-butyl 4-[3-(3-acetyloxyphenyl)-1-hydroxy-2-nitropropyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

HRID 115446Notes

Reaction equation

HRID 115446 reaction equation
[CH3:33][CH2:34][CH2:35][CH2:36][N+:37]([CH2:38][CH2:39][CH2:40][CH3:41])([CH2:42][CH2:43][CH2:44][CH3:45])[CH2:46][CH2:47][CH2:48][CH3:49].[CH:16](=[O:17])[CH:18]1[N:19]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[C:20]([CH3:23])([CH3:24])[O:21][CH2:22]1.[F-:32].[N+:1](=[O:2])([O-:3])[CH2:4][CH2:5][c:6]1[cH:7][c:8]([O:12][C:13]([CH3:14])=[O:15])[cH:9][cH:10][cH:11]1.[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH2:50]>>[N+:1](=[O:2])([O-:3])[CH:4]([CH2:5][c:6]1[cH:7][c:8]([O:12][C:13]([CH3:14])=[O:15])[cH:9][cH:10][cH:11]1)[CH:16]([OH:17])[CH:18]1[N:19]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[C:20]([CH3:23])([CH3:24])[O:21][CH2:22]1

Participants

7

Reactant 6

HCID 962WaterHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 36440903-Boc-2,2-dimethyloxazolidine-4-carboxaldehyde, (A+-)-HCID 68563888Acetic acid 3-(2-nitroethyl)-phenyl ester

Product 1

HCID 68560982Tert-butyl 4-[3-(3-acetyloxyphenyl)-1-hydroxy-2-nitropropyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Sources & evidence

ORD record
ord-39d219467cfe4567a74333ad26a94ecc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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